N-(4-chloranyl-2-nitro-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-yl]propanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-yl]propanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-N-(4-chloro-2-nitro-phenyl)propanamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazinyl]-N-(4-chloro-2-nitrophenyl)propanamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-N-(4-chloro-2-nitrophenyl)propanamide Traditional Name: 2-[4-(4-acetylphenyl)piperazino]-N-(4-chloro-2-nitro-phenyl)propionamide Formula: C21H23ClN4O4 MolecularWeight: 430.88472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

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