4-[3-(cyanomethyl)phenyl]-N-[3-(4-cyano-1-propan-2-yl-piperidin-4-yl)-4-methoxy-phenyl]benzamide

Systemtic Name: 4-[3-(cyanomethyl)phenyl]-N-[3-(4-cyano-1-propan-2-yl-piperidin-4-yl)-4-methoxy-phenyl]benzamide Openeye Name: N-[3-(4-cyano-1-isopropyl-4-piperidyl)-4-methoxy-phenyl]-4-[3-(cyanomethyl)phenyl]benzamide CAS Name: 4-[3-(cyanomethyl)phenyl]-N-[3-(4-cyano-1-propan-2-yl-4-piperidinyl)-4-methoxyphenyl]benzamide IUPAC Name: 4-[3-(cyanomethyl)phenyl]-N-[3-(4-cyano-1-propan-2-ylpiperidin-4-yl)-4-methoxyphenyl]benzamide Traditional Name: N-[3-(4-cyano-1-isopropyl-4-piperidyl)-4-methoxy-phenyl]-4-[3-(cyanomethyl)phenyl]benzamide Formula: C31H32N4O2 MolecularWeight: 492.61138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)(C#N)C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)CC#N)OC

Isomeric SMILES

CC(C)N1CCC(CC1)(C#N)C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)CC#N)OC

InChI

InChI=1S/C31H32N4O2/c1-22(2)35-17-14-31(21-33,15-18-35)28-20-27(11-12-29(28)37-3)34-30(36)25-9-7-24(8-10-25)26-6-4-5-23(19-26)13-16-32/h4-12,19-20,22H,13-15,17-18H2,1-3H3,(H,34,36)