2-[2-[(2-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylic acid

Systemtic Name: 2-[2-[(2-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylic acid Openeye Name: 2-[2-(2-methoxycarbonylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzoxazole-5-carboxylic acid CAS Name: 2-[[2-(2-methoxycarbonylanilino)-2-oxoethyl]thio]-1,3-benzoxazole-5-carboxylic acid IUPAC Name: 2-[2-(2-methoxycarbonylanilino)-2-oxoethyl]sulfanyl-1,3-benzoxazole-5-carboxylic acid Traditional Name: 2-[[2-(2-carbomethoxyanilino)-2-keto-ethyl]thio]-1,3-benzoxazole-5-carboxylic acid Formula: C18H14N2O6S MolecularWeight: 386.37856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C18H14N2O6S/c1-25-17(24)11-4-2-3-5-12(11)19-15(21)9-27-18-20-13-8-10(16(22)23)6-7-14(13)26-18/h2-8H,9H2,1H3,(H,19,21)(H,22,23)