4-(azepan-1-ylmethyl)-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[[4-(3-methyl-1-piperidyl)phenyl]methyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[[4-(3-methyl-1-piperidinyl)phenyl]methyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[4-(3-methylpiperidino)benzyl]benzamide Formula: C27H37N3O MolecularWeight: 419.60218

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CN4CCCCCC4

Isomeric SMILES

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CN4CCCCCC4

InChI

InChI=1S/C27H37N3O/c1-22-7-6-18-30(20-22)26-14-10-23(11-15-26)19-28-27(31)25-12-8-24(9-13-25)21-29-16-4-2-3-5-17-29/h8-15,22H,2-7,16-21H2,1H3,(H,28,31)