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

Systemtic Name: 2-[(4-methoxyphenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-phenyl-ethanone Openeye Name: 2-[4-methoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenyl-ethanone CAS Name: 2-[4-methoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenylethanone IUPAC Name: 2-[4-methoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenylethanone Traditional Name: 2-[4-methoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]-1-phenyl-ethanone Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)C2=CC=CC=C2)C3=NCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)C2=CC=CC=C2)C3=NCCCCC3

InChI

InChI=1S/C21H24N2O2/c1-25-19-13-11-18(12-14-19)23(21-10-6-3-7-15-22-21)16-20(24)17-8-4-2-5-9-17/h2,4-5,8-9,11-14H,3,6-7,10,15-16H2,1H3