2-[(3-methylphenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-phenyl-ethanone

Systemtic Name: 2-[(3-methylphenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-phenyl-ethanone Openeye Name: 2-[3-methyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenyl-ethanone CAS Name: 2-[3-methyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenylethanone IUPAC Name: 2-[3-methyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenylethanone Traditional Name: 2-[3-methyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenyl-ethanone Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)C2=CC=CC=C2)C3=NCCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)C2=CC=CC=C2)C3=NCCCCC3

InChI

InChI=1S/C21H24N2O/c1-17-9-8-12-19(15-17)23(21-13-6-3-7-14-22-21)16-20(24)18-10-4-2-5-11-18/h2,4-5,8-12,15H,3,6-7,13-14,16H2,1H3