U4C

(2S)-1',4'-dihydro-2'H-spiro[pyrrolidine-2,3'-quinolin]-2'-one

Created:	2023-08-29
Last modified:	2023-11-29

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2 entries where U4C is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	1
Bond Count	31
Aromatic Bond Count	6

2D diagram of U4C

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Chemical Component Summary
Name	(2S)-1',4'-dihydro-2'H-spiro[pyrrolidine-2,3'-quinolin]-2'-one
Systematic Name (OpenEye OEToolkits)	(3~{S})-spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one
Formula	C₁₂ H₁₄ N₂ O
Molecular Weight	202.252
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C1Nc2ccccc2CC21CCCN2
SMILES	CACTVS	3.385	O=C1Nc2ccccc2C[C]13CCCN3
SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)CC3(CCCN3)C(=O)N2
Canonical SMILES	CACTVS	3.385	O=C1Nc2ccccc2C[C@@]13CCCN3
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)C[C@@]3(CCCN3)C(=O)N2
InChI	InChI	1.06	InChI=1S/C12H14N2O/c15-11-12(6-3-7-13-12)8-9-4-1-2-5-10(9)14-11/h1-2,4-5,13H,3,6-8H2,(H,14,15)/t12-/m0/s1
InChIKey	InChI	1.06	ABOZUPQQWCLVDB-LBPRGKRZSA-N

Related Resource References

Resource Name	Reference
PubChem	169447955

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