[4-(4-chlorophenyl)piperazin-1-yl]-(4-methyl-3,5-dinitro-phenyl)methanone

Systemtic Name: [4-(4-chlorophenyl)piperazin-1-yl]-(4-methyl-3,5-dinitro-phenyl)methanone Openeye Name: [4-(4-chlorophenyl)piperazin-1-yl]-(4-methyl-3,5-dinitro-phenyl)methanone CAS Name: [4-(4-chlorophenyl)-1-piperazinyl]-(4-methyl-3,5-dinitrophenyl)methanone IUPAC Name: [4-(4-chlorophenyl)piperazin-1-yl]-(4-methyl-3,5-dinitrophenyl)methanone Traditional Name: [4-(4-chlorophenyl)piperazino]-(4-methyl-3,5-dinitro-phenyl)methanone Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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