[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone

Systemtic Name: [4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone Openeye Name: [4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone CAS Name: [4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: [4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(4-methyl-3-nitrophenyl)methanone Traditional Name: [4-(2-chloro-6-nitro-phenyl)piperazino]-(4-methyl-3-nitro-phenyl)methanone Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O5/c1-12-5-6-13(11-16(12)23(27)28)18(24)21-9-7-20(8-10-21)17-14(19)3-2-4-15(17)22(25)26/h2-6,11H,7-10H2,1H3