methyl 2-[(5-chloranylthiophen-2-yl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(5-chloranylthiophen-2-yl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(5-chlorothiophene-2-carbonyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(5-chloro-2-thiophenyl)-oxomethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chlorothiophene-2-carbonyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(5-chlorothiophene-2-carbonyl)oxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C16H11ClN2O5S MolecularWeight: 378.78694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H11ClN2O5S/c1-23-15(21)8-2-3-9-10(6-8)18-13(19-14(9)20)7-24-16(22)11-4-5-12(17)25-11/h2-6H,7H2,1H3,(H,18,19,20)