3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(phenylsulfonyl)thiophene-2-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(phenylsulfonyl)thiophene-2-carboxylic acid Openeye Name: 4-(benzenesulfonyl)-3-(tert-butoxycarbonylamino)thiophene-2-carboxylic acid CAS Name: 4-(benzenesulfonyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 4-(benzenesulfonyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Traditional Name: 4-besyl-3-(tert-butoxycarbonylamino)-2-thenoic acid Formula: C16H17NO6S2 MolecularWeight: 383.43928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(SC=C1S(=O)(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(SC=C1S(=O)(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO6S2/c1-16(2,3)23-15(20)17-12-11(9-24-13(12)14(18)19)25(21,22)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,17,20)(H,18,19)