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

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazino]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CCC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CCC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C22H28N4O3/c1-16-6-4-8-20(17(16)2)25-14-12-24(13-15-25)11-10-22(27)23-19-7-5-9-21(18(19)3)26(28)29/h4-9H,10-15H2,1-3H3,(H,23,27)