[4-[(4-bromophenyl)-phenyl-methyl]piperazin-1-yl]-(2,4-dimethoxyphenyl)methanone

Systemtic Name: [4-[(4-bromophenyl)-phenyl-methyl]piperazin-1-yl]-(2,4-dimethoxyphenyl)methanone Openeye Name: [4-[(4-bromophenyl)-phenyl-methyl]piperazin-1-yl]-(2,4-dimethoxyphenyl)methanone CAS Name: [4-[(4-bromophenyl)-phenylmethyl]-1-piperazinyl]-(2,4-dimethoxyphenyl)methanone IUPAC Name: [4-[(4-bromophenyl)-phenylmethyl]piperazin-1-yl]-(2,4-dimethoxyphenyl)methanone Traditional Name: [4-[(4-bromophenyl)-phenyl-methyl]piperazino]-(2,4-dimethoxyphenyl)methanone Formula: C26H27BrN2O3 MolecularWeight: 495.40818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C26H27BrN2O3/c1-31-22-12-13-23(24(18-22)32-2)26(30)29-16-14-28(15-17-29)25(19-6-4-3-5-7-19)20-8-10-21(27)11-9-20/h3-13,18,25H,14-17H2,1-2H3