3-methyl-5-(phenylmethoxycarbonylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(phenylmethoxycarbonylamino)thiophene-2-carboxylic acid Openeye Name: 5-(benzyloxycarbonylamino)-3-methyl-thiophene-2-carboxylic acid CAS Name: 3-methyl-5-(phenylmethoxycarbonylamino)-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-(phenylmethoxycarbonylamino)thiophene-2-carboxylic acid Traditional Name: 5-(benzyloxycarbonylamino)-3-methyl-2-thenoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H13NO4S/c1-9-7-11(20-12(9)13(16)17)15-14(18)19-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,15,18)(H,16,17)