(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl thiophene-3-carboxylate

Systemtic Name: (7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl thiophene-3-carboxylate Openeye Name: (7-chloro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid (7-chloro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid (7-chloro-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C14H9ClN2O3S MolecularWeight: 320.75086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1Cl)COC(=O)C3=CSC=C3

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1Cl)COC(=O)C3=CSC=C3

InChI

InChI=1S/C14H9ClN2O3S/c15-10-1-2-12-16-11(5-13(18)17(12)6-10)7-20-14(19)9-3-4-21-8-9/h1-6,8H,7H2