4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-oxo-butanoic acid CAS Name: 4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-oxobutanoic acid IUPAC Name: 4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-oxobutanoic acid Traditional Name: 4-[(3-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-(2-hydroxyethylamino)-4-keto-butyric acid Formula: C17H24N2O6S MolecularWeight: 384.44726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC(C(=O)O)NCCO

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC(C(=O)O)NCCO

InChI

InChI=1S/C17H24N2O6S/c1-2-25-17(24)14-10-5-3-4-6-12(10)26-15(14)19-13(21)9-11(16(22)23)18-7-8-20/h11,18,20H,2-9H2,1H3,(H,19,21)(H,22,23)