2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-N-(2-methyl-4-nitro-phenyl)propanamide

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 2-[4-(4-chlorobenzoyl)piperazino]-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C21H23ClN4O4 MolecularWeight: 430.88472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN4O4/c1-14-13-18(26(29)30)7-8-19(14)23-20(27)15(2)24-9-11-25(12-10-24)21(28)16-3-5-17(22)6-4-16/h3-8,13,15H,9-12H2,1-2H3,(H,23,27)