3-bromanyl-4-ethoxy-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-bromo-4-ethoxy-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-3-bromo-4-ethoxybenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-bromo-4-ethoxybenzamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]-3-bromo-4-ethoxy-benzamide Formula: C26H26BrN3O3 MolecularWeight: 508.40694

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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=CC=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C26H26BrN3O3/c1-2-33-24-13-8-20(18-23(24)27)25(31)28-21-9-11-22(12-10-21)29-14-16-30(17-15-29)26(32)19-6-4-3-5-7-19/h3-13,18H,2,14-17H2,1H3,(H,28,31)