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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC(=CC(=C4OC)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC(=CC(=C4OC)C)Br

InChI

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