4-bromanyl-N-[(3-ethoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide

Systemtic Name: 4-bromanyl-N-[(3-ethoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzamide Openeye Name: 4-bromo-N-[(3-ethoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-yl-ethyl)benzamide CAS Name: 4-bromo-N-[(3-ethoxyphenyl)methyl]-N-[2-oxo-2-(1-piperazinyl)ethyl]benzamide IUPAC Name: 4-bromo-N-[(3-ethoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-ylethyl)benzamide Traditional Name: 4-bromo-N-(3-ethoxybenzyl)-N-(2-keto-2-piperazino-ethyl)benzamide Formula: C22H26BrN3O3 MolecularWeight: 460.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN(CC(=O)N2CCNCC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=CC(=C1)CN(CC(=O)N2CCNCC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H26BrN3O3/c1-2-29-20-5-3-4-17(14-20)15-26(16-21(27)25-12-10-24-11-13-25)22(28)18-6-8-19(23)9-7-18/h3-9,14,24H,2,10-13,15-16H2,1H3