N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-(2-nitrophenyl)ethanamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-2-(2-nitrophenyl)acetamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-(2-nitrophenyl)acetamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]propyl]-2-(2-nitrophenyl)acetamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-18-6-4-8-20(16-18)25-14-12-24(13-15-25)11-5-10-23-22(27)17-19-7-2-3-9-21(19)26(28)29/h2-4,6-9,16H,5,10-15,17H2,1H3,(H,23,27)