5-bromanyl-2-methoxy-3-methyl-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-3-methyl-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 5-bromo-2-methoxy-3-methyl-N-[4-(4-o-toluoylpiperazino)phenyl]benzamide Formula: C27H28BrN3O3 MolecularWeight: 522.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4OC)C)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4OC)C)Br

InChI

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