N-(4-chloranyl-3-nitro-phenyl)-2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[3-methyl-4-(p-tolyl)piperazin-1-yl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[3-methyl-4-(4-methylphenyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[3-methyl-4-(p-tolyl)piperazino]acetamide Formula: C20H23ClN4O3 MolecularWeight: 402.87462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)CC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O3/c1-14-3-6-17(7-4-14)24-10-9-23(12-15(24)2)13-20(26)22-16-5-8-18(21)19(11-16)25(27)28/h3-8,11,15H,9-10,12-13H2,1-2H3,(H,22,26)