(3-chloranyl-4,5-dimethoxy-phenyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)-1-azepanyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC(=C(C(=C3)Cl)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC(=C(C(=C3)Cl)OC)OC

InChI

InChI=1S/C22H26ClNO4/c1-26-17-10-8-15(9-11-17)19-7-5-4-6-12-24(19)22(25)16-13-18(23)21(28-3)20(14-16)27-2/h8-11,13-14,19H,4-7,12H2,1-3H3