[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone

Systemtic Name: [4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone Openeye Name: [4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: [4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-(3-methyl-2-nitrophenyl)methanone IUPAC Name: [4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitrophenyl)methanone Traditional Name: [4-(3,4-dichlorophenyl)sulfonylpiperazino]-(3-methyl-2-nitro-phenyl)methanone Formula: C18H17Cl2N3O5S MolecularWeight: 458.31568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl2N3O5S/c1-12-3-2-4-14(17(12)23(25)26)18(24)21-7-9-22(10-8-21)29(27,28)13-5-6-15(19)16(20)11-13/h2-6,11H,7-10H2,1H3