N-(3-cyano-4-phenyl-phenyl)-N-methyl-1-(pentanoylamino)cyclohexane-1-carboxamide

Systemtic Name: N-(3-cyano-4-phenyl-phenyl)-N-methyl-1-(pentanoylamino)cyclohexane-1-carboxamide Openeye Name: N-(3-cyano-4-phenyl-phenyl)-N-methyl-1-(pentanoylamino)cyclohexanecarboxamide CAS Name: N-(3-cyano-4-phenylphenyl)-N-methyl-1-(1-oxopentylamino)-1-cyclohexanecarboxamide IUPAC Name: N-(3-cyano-4-phenylphenyl)-N-methyl-1-(pentanoylamino)cyclohexane-1-carboxamide Traditional Name: N-(3-cyano-4-phenyl-phenyl)-N-methyl-1-(valerylamino)cyclohexanecarboxamide Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1(CCCCC1)C(=O)N(C)C2=CC(=C(C=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCC(=O)NC1(CCCCC1)C(=O)N(C)C2=CC(=C(C=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C26H31N3O2/c1-3-4-13-24(30)28-26(16-9-6-10-17-26)25(31)29(2)22-14-15-23(21(18-22)19-27)20-11-7-5-8-12-20/h5,7-8,11-12,14-15,18H,3-4,6,9-10,13,16-17H2,1-2H3,(H,28,30)