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

Systemtic Name: 5-bromanyl-N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-methoxy-3-methyl-benzamide Openeye Name: 5-bromo-N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-methoxy-3-methyl-benzamide CAS Name: 5-bromo-N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-2-methoxy-3-methyl-benzamide Formula: C27H27BrClN3O3 MolecularWeight: 556.87858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27BrClN3O3/c1-17-6-4-5-7-21(17)27(34)32-12-10-31(11-13-32)24-9-8-20(16-23(24)29)30-26(33)22-15-19(28)14-18(2)25(22)35-3/h4-9,14-16H,10-13H2,1-3H3,(H,30,33)