N-(4-bromanyl-2-methyl-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]propanamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-(3-chlorophenyl)-1-piperazinyl]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(3-chlorophenyl)piperazino]propionamide Formula: C20H23BrClN3O MolecularWeight: 436.77312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C(C)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C(C)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23BrClN3O/c1-14-12-16(21)6-7-19(14)23-20(26)15(2)24-8-10-25(11-9-24)18-5-3-4-17(22)13-18/h3-7,12-13,15H,8-11H2,1-2H3,(H,23,26)