N-[(4-bromophenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide

Systemtic Name: N-[(4-bromophenyl)methyl]-3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide Openeye Name: N-[(4-bromophenyl)methyl]-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-yl-ethyl)benzamide CAS Name: N-[(4-bromophenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(1-piperazinyl)ethyl]benzamide IUPAC Name: N-[(4-bromophenyl)methyl]-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-ylethyl)benzamide Traditional Name: N-(4-bromobenzyl)-N-(2-keto-2-piperazino-ethyl)-3,4-dimethoxy-benzamide Formula: C22H26BrN3O4 MolecularWeight: 476.36354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=C(C=C2)Br)CC(=O)N3CCNCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=C(C=C2)Br)CC(=O)N3CCNCC3)OC

InChI

InChI=1S/C22H26BrN3O4/c1-29-19-8-5-17(13-20(19)30-2)22(28)26(14-16-3-6-18(23)7-4-16)15-21(27)25-11-9-24-10-12-25/h3-8,13,24H,9-12,14-15H2,1-2H3