4-[(5-aminocarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(5-aminocarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(5-carbamoyl-3-methoxycarbonyl-4-methyl-2-thienyl)amino]-4-oxo-butanoate CAS Name: 4-[(5-carbamoyl-3-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-4-oxobutanoate IUPAC Name: 4-[(5-carbamoyl-3-methoxycarbonyl-4-methylthiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(5-carbamoyl-3-carbomethoxy-4-methyl-2-thienyl)amino]-4-keto-butyrate Formula: C12H13N2O6S- MolecularWeight: 313.30642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC(=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC(=O)[O-])C(=O)N

InChI

InChI=1S/C12H14N2O6S/c1-5-8(12(19)20-2)11(21-9(5)10(13)18)14-6(15)3-4-7(16)17/h3-4H2,1-2H3,(H2,13,18)(H,14,15)(H,16,17)/p-1