1-(8-chloranyl-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone

Systemtic Name: 1-(8-chloranyl-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone Openeye Name: 1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone CAS Name: 1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone IUPAC Name: 1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone Traditional Name: 1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-(4-dimethylaminophenyl)ethanone Formula: C27H29ClN2O2 MolecularWeight: 448.98436

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CC(=O)N2CCC3=CC(=C(C=C3C(C2)C4=CC=CC=C4)OC)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CC(=O)N2CCC3=CC(=C(C=C3C(C2)C4=CC=CC=C4)OC)Cl

InChI

InChI=1S/C27H29ClN2O2/c1-29(2)22-11-9-19(10-12-22)15-27(31)30-14-13-21-16-25(28)26(32-3)17-23(21)24(18-30)20-7-5-4-6-8-20/h4-12,16-17,24H,13-15,18H2,1-3H3