2-[[4-methoxy-2-(4-methyl-3-nitro-phenyl)sulfonyl-phenyl]amino]ethanoic acid

Systemtic Name: 2-[[4-methoxy-2-(4-methyl-3-nitro-phenyl)sulfonyl-phenyl]amino]ethanoic acid Openeye Name: 2-[4-methoxy-2-(4-methyl-3-nitro-phenyl)sulfonyl-anilino]acetic acid CAS Name: 2-[4-methoxy-2-(4-methyl-3-nitrophenyl)sulfonylanilino]acetic acid IUPAC Name: 2-[4-methoxy-2-(4-methyl-3-nitrophenyl)sulfonylanilino]acetic acid Traditional Name: 2-[4-methoxy-2-(4-methyl-3-nitro-phenyl)sulfonyl-anilino]acetic acid Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC)NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC)NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O7S/c1-10-3-5-12(8-14(10)18(21)22)26(23,24)15-7-11(25-2)4-6-13(15)17-9-16(19)20/h3-8,17H,9H2,1-2H3,(H,19,20)