(4-chloranyl-3,5-dinitro-phenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3,5-dinitro-phenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3,5-dinitro-phenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone CAS Name: (4-chloro-3,5-dinitrophenyl)-[4-(2,3-dimethylphenyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3,5-dinitrophenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3,5-dinitro-phenyl)-[4-(2,3-dimethylphenyl)piperazino]methanone Formula: C19H19ClN4O5 MolecularWeight: 418.83096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN4O5/c1-12-4-3-5-15(13(12)2)21-6-8-22(9-7-21)19(25)14-10-16(23(26)27)18(20)17(11-14)24(28)29/h3-5,10-11H,6-9H2,1-2H3