N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-cyano-2-[(4-piperidin-1-ylcyclohexyl)carbonylamino]benzamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-cyano-2-[(4-piperidin-1-ylcyclohexyl)carbonylamino]benzamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-5-cyano-2-[[4-(1-piperidyl)cyclohexanecarbonyl]amino]benzamide CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5-cyano-2-[[oxo-[4-(1-piperidinyl)cyclohexyl]methyl]amino]benzamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-5-cyano-2-[(4-piperidin-1-ylcyclohexanecarbonyl)amino]benzamide Traditional Name: N-(3-chloro-4-methoxy-benzyl)-5-cyano-2-[(4-piperidinocyclohexanecarbonyl)amino]benzamide Formula: C28H33ClN4O3 MolecularWeight: 509.03962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)C#N)NC(=O)C3CCC(CC3)N4CCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)C#N)NC(=O)C3CCC(CC3)N4CCCCC4)Cl

InChI

InChI=1S/C28H33ClN4O3/c1-36-26-12-6-20(16-24(26)29)18-31-28(35)23-15-19(17-30)5-11-25(23)32-27(34)21-7-9-22(10-8-21)33-13-3-2-4-14-33/h5-6,11-12,15-16,21-22H,2-4,7-10,13-14,18H2,1H3,(H,31,35)(H,32,34)