methyl 3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)OC)Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)OC)Cl)OCC(=O)N

InChI

InChI=1S/C16H15ClN2O6S/c1-23-11-6-8(5-9(17)13(11)25-7-12(18)20)15(21)19-10-3-4-26-14(10)16(22)24-2/h3-6H,7H2,1-2H3,(H2,18,20)(H,19,21)