(3-methoxy-4-methyl-phenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-methoxy-4-methyl-phenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(3-methoxy-4-methyl-phenyl)methanone CAS Name: (3-methoxy-4-methylphenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(3-methoxy-4-methylphenyl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(3-methoxy-4-methyl-phenyl)methanone Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H26N2O2/c1-17-9-10-19(15-20(17)25-2)21(24)23-12-6-11-22(13-14-23)16-18-7-4-3-5-8-18/h3-5,7-10,15H,6,11-14,16H2,1-2H3