N-[2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-methyl-benzamide

Systemtic Name: N-[2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-methyl-benzamide Openeye Name: N-[2-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-oxo-ethyl]-2-methyl-benzamide CAS Name: N-[2-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]-2-methylbenzamide IUPAC Name: N-[2-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]-2-methylbenzamide Traditional Name: N-[2-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-keto-ethyl]-2-methyl-benzamide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O4/c1-14-4-2-3-5-16(14)20(27)22-13-19(26)24-10-8-23(9-11-24)17-7-6-15(21)12-18(17)25(28)29/h2-7,12H,8-11,13H2,1H3,(H,22,27)