4-(azepan-1-ylmethyl)-N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[1-[4-(4-methyl-1-piperidyl)phenyl]ethyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[1-[4-(4-methyl-1-piperidinyl)phenyl]ethyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[1-[4-(4-methylpiperidin-1-yl)phenyl]ethyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[1-[4-(4-methylpiperidino)phenyl]ethyl]benzamide Formula: C28H39N3O MolecularWeight: 433.62876

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC=C(C=C3)CN4CCCCCC4

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)C(C)NC(=O)C3=CC=C(C=C3)CN4CCCCCC4

InChI

InChI=1S/C28H39N3O/c1-22-15-19-31(20-16-22)27-13-11-25(12-14-27)23(2)29-28(32)26-9-7-24(8-10-26)21-30-17-5-3-4-6-18-30/h7-14,22-23H,3-6,15-21H2,1-2H3,(H,29,32)