2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)propanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)propanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)propanamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-N-(2,3-dimethyl-6-nitrophenyl)propanamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2,3-dimethyl-6-nitrophenyl)propanamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazino]-N-(2,3-dimethyl-6-nitro-phenyl)propionamide Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C(C)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C(C)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H27ClN4O3/c1-15-4-9-20(27(29)30)21(16(15)2)24-22(28)17(3)26-12-10-25(11-13-26)14-18-5-7-19(23)8-6-18/h4-9,17H,10-14H2,1-3H3,(H,24,28)