N-(4-bromanyl-2-methyl-phenyl)-2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]propanamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(4-veratroylpiperazino)propionamide Formula: C23H28BrN3O4 MolecularWeight: 490.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H28BrN3O4/c1-15-13-18(24)6-7-19(15)25-22(28)16(2)26-9-11-27(12-10-26)23(29)17-5-8-20(30-3)21(14-17)31-4/h5-8,13-14,16H,9-12H2,1-4H3,(H,25,28)