methyl 4-[3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonylpropanoylamino]benzoate

Systemtic Name: methyl 4-[3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonylpropanoylamino]benzoate Openeye Name: methyl 4-[3-(1,4-dimethyl-2,3-dioxo-quinoxalin-6-yl)sulfonylpropanoylamino]benzoate CAS Name: 4-[[3-[(1,4-dimethyl-2,3-dioxo-6-quinoxalinyl)sulfonyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,4-dimethyl-2,3-dioxoquinoxalin-6-yl)sulfonylpropanoylamino]benzoate Traditional Name: 4-[3-(2,3-diketo-1,4-dimethyl-quinoxalin-6-yl)sulfonylpropanoylamino]benzoic acid methyl ester Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NC3=CC=C(C=C3)C(=O)OC)N(C(=O)C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NC3=CC=C(C=C3)C(=O)OC)N(C(=O)C1=O)C

InChI

InChI=1S/C21H21N3O7S/c1-23-16-9-8-15(12-17(16)24(2)20(27)19(23)26)32(29,30)11-10-18(25)22-14-6-4-13(5-7-14)21(28)31-3/h4-9,12H,10-11H2,1-3H3,(H,22,25)