[5-(4-methylphenyl)sulfonyl-1H-pyrrol-3-yl]-(5-nitro-2-oxidanyl-phenyl)methanone

Systemtic Name: [5-(4-methylphenyl)sulfonyl-1H-pyrrol-3-yl]-(5-nitro-2-oxidanyl-phenyl)methanone Openeye Name: (2-hydroxy-5-nitro-phenyl)-[5-(p-tolylsulfonyl)-1H-pyrrol-3-yl]methanone CAS Name: (2-hydroxy-5-nitrophenyl)-[5-(4-methylphenyl)sulfonyl-1H-pyrrol-3-yl]methanone IUPAC Name: (2-hydroxy-5-nitrophenyl)-[5-(4-methylphenyl)sulfonyl-1H-pyrrol-3-yl]methanone Traditional Name: (2-hydroxy-5-nitro-phenyl)-(5-tosyl-1H-pyrrol-3-yl)methanone Formula: C18H14N2O6S MolecularWeight: 386.37856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CN2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CN2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H14N2O6S/c1-11-2-5-14(6-3-11)27(25,26)17-8-12(10-19-17)18(22)15-9-13(20(23)24)4-7-16(15)21/h2-10,19,21H,1H3