methyl 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonyl-cyclohexa-2,4-dien-1-yl]amino]ethanoate

Systemtic Name: methyl 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonyl-cyclohexa-2,4-dien-1-yl]amino]ethanoate Openeye Name: methyl 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonyl-cyclohexa-2,4-dien-1-yl]amino]acetate CAS Name: 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonyl-1-cyclohexa-2,4-dienyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonylcyclohexa-2,4-dien-1-yl]amino]acetate Traditional Name: 2-[[4,6-dimethoxy-6-(2-nitrophenyl)sulfonyl-cyclohexa-2,4-dien-1-yl]amino]acetic acid methyl ester Formula: C17H20N2O8S MolecularWeight: 412.4143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(C(C=C1)NCC(=O)OC)(OC)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC(C(C=C1)NCC(=O)OC)(OC)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O8S/c1-25-12-8-9-15(18-11-16(20)26-2)17(10-12,27-3)28(23,24)14-7-5-4-6-13(14)19(21)22/h4-10,15,18H,11H2,1-3H3