2-[(2-oxidanylidenecyclohexyl)amino]-4-[(3,4,5-trimethoxyphenyl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-oxidanylidenecyclohexyl)amino]-4-[(3,4,5-trimethoxyphenyl)methyl]benzenecarbonitrile Openeye Name: 2-[(2-oxocyclohexyl)amino]-4-[(3,4,5-trimethoxyphenyl)methyl]benzonitrile CAS Name: 2-[(2-oxocyclohexyl)amino]-4-[(3,4,5-trimethoxyphenyl)methyl]benzonitrile IUPAC Name: 2-[(2-oxocyclohexyl)amino]-4-[(3,4,5-trimethoxyphenyl)methyl]benzonitrile Traditional Name: 2-[(2-ketocyclohexyl)amino]-4-(3,4,5-trimethoxybenzyl)benzonitrile Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CC(=C(C=C2)C#N)NC3CCCCC3=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CC(=C(C=C2)C#N)NC3CCCCC3=O

InChI

InChI=1S/C23H26N2O4/c1-27-21-12-16(13-22(28-2)23(21)29-3)10-15-8-9-17(14-24)19(11-15)25-18-6-4-5-7-20(18)26/h8-9,11-13,18,25H,4-7,10H2,1-3H3