5-[[(2S)-1,5-diethoxy-1,5-bis(oxidanylidene)pentan-2-yl]carbamoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(2S)-1,5-diethoxy-1,5-bis(oxidanylidene)pentan-2-yl]carbamoyl]thiophene-2-carboxylic acid Openeye Name: 5-[[(1S)-4-ethoxy-1-ethoxycarbonyl-4-oxo-butyl]carbamoyl]thiophene-2-carboxylic acid CAS Name: 5-[[[(2S)-1,5-diethoxy-1,5-dioxopentan-2-yl]amino]-oxomethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(2S)-1,5-diethoxy-1,5-dioxopentan-2-yl]carbamoyl]thiophene-2-carboxylic acid Traditional Name: 5-[[(1S)-1-carbethoxy-4-ethoxy-4-keto-butyl]carbamoyl]-2-thenoic acid Formula: C15H19NO7S MolecularWeight: 357.37886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(S1)C(=O)O

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(S1)C(=O)O

InChI

InChI=1S/C15H19NO7S/c1-3-22-12(17)8-5-9(15(21)23-4-2)16-13(18)10-6-7-11(24-10)14(19)20/h6-7,9H,3-5,8H2,1-2H3,(H,16,18)(H,19,20)/t9-/m0/s1