3-bromanyl-4-ethoxy-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[4-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C27H28BrN3O3 MolecularWeight: 522.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C)Br

InChI

InChI=1S/C27H28BrN3O3/c1-3-34-25-13-8-21(18-24(25)28)26(32)29-22-9-11-23(12-10-22)30-14-16-31(17-15-30)27(33)20-6-4-19(2)5-7-20/h4-13,18H,3,14-17H2,1-2H3,(H,29,32)