methyl 3-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H13ClN2O5S MolecularWeight: 380.80282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O5S/c1-23-16(22)15-10(4-5-25-15)18-13(20)7-19-11-6-9(17)2-3-12(11)24-8-14(19)21/h2-6H,7-8H2,1H3,(H,18,20)