2-(carboxycarbonylamino)-5-[[(3-methoxyphenyl)carbamoylamino]methyl]thiophene-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-5-[[(3-methoxyphenyl)carbamoylamino]methyl]thiophene-3-carboxylic acid Openeye Name: 5-[[(3-methoxyphenyl)carbamoylamino]methyl]-2-(oxaloamino)thiophene-3-carboxylic acid CAS Name: 5-[[[(3-methoxyanilino)-oxomethyl]amino]methyl]-2-(oxaloamino)-3-thiophenecarboxylic acid IUPAC Name: 5-[[(3-methoxyphenyl)carbamoylamino]methyl]-2-(oxaloamino)thiophene-3-carboxylic acid Traditional Name: 5-[[(3-methoxyphenyl)carbamoylamino]methyl]-2-(oxaloamino)-3-thenoic acid Formula: C16H15N3O7S MolecularWeight: 393.3712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NCC2=CC(=C(S2)NC(=O)C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NCC2=CC(=C(S2)NC(=O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H15N3O7S/c1-26-9-4-2-3-8(5-9)18-16(25)17-7-10-6-11(14(21)22)13(27-10)19-12(20)15(23)24/h2-6H,7H2,1H3,(H,19,20)(H,21,22)(H,23,24)(H2,17,18,25)