SU7

3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propanenitrile

Created:	2020-03-11
Last modified:	2020-07-22

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2 entries where SU7 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	36
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	6

2D diagram of SU7

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Chemical Component Summary
Name	3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propanenitrile
Systematic Name (OpenEye OEToolkits)	3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propanenitrile
Formula	C₁₅ H₁₈ N₂ O
Molecular Weight	242.316
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=C(CC#N)N1CCC(CC1)Cc2ccccc2
SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)CC2CCN(CC2)C(=O)CC#N
Canonical SMILES	CACTVS	3.385	O=C(CC#N)N1CCC(CC1)Cc2ccccc2
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)CC2CCN(CC2)C(=O)CC#N
InChI	InChI	1.03	InChI=1S/C15H18N2O/c16-9-6-15(18)17-10-7-14(8-11-17)12-13-4-2-1-3-5-13/h1-5,14H,6-8,10-12H2
InChIKey	InChI	1.03	ZCRMYTZFCMQXHR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	1540933

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