5-(4-methoxyphenyl)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-(4-methoxyphenyl)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-5-(4-methoxyphenyl)-4-methyl-thiophene-2-carboxylic acid CAS Name: 5-(4-methoxyphenyl)-4-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(4-methoxyphenyl)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-5-(4-methoxyphenyl)-4-methyl-2-thenoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1NC(=O)OC(C)(C)C)C(=O)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(SC(=C1NC(=O)OC(C)(C)C)C(=O)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H21NO5S/c1-10-13(19-17(22)24-18(2,3)4)15(16(20)21)25-14(10)11-6-8-12(23-5)9-7-11/h6-9H,1-5H3,(H,19,22)(H,20,21)