dimethyl 5-azanyl-3-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(2-butyl-1,3-dioxo-isoindoline-5-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(2-butyl-1,3-dioxo-5-isoindolyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(2-butyl-1,3-dioxoisoindole-5-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(2-butyl-1,3-diketo-isoindoline-5-carbonyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H22N2O8S MolecularWeight: 474.48368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C22H22N2O8S/c1-4-5-8-24-18(25)12-7-6-11(9-13(12)19(24)26)20(27)32-10-14-15(21(28)30-2)17(23)33-16(14)22(29)31-3/h6-7,9H,4-5,8,10,23H2,1-3H3