(7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 5-sulfamoylthiophene-3-carboxylate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 5-sulfamoylthiophene-3-carboxylate Openeye Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 5-sulfamoylthiophene-3-carboxylate CAS Name: 5-sulfamoyl-3-thiophenecarboxylic acid (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 5-sulfamoylthiophene-3-carboxylate Traditional Name: 5-sulfamoylthiophene-3-carboxylic acid (7-chloro-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C14H11ClN3O5S2+ MolecularWeight: 400.83724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=[N+](C=C1Cl)C(=O)C=C(N2)COC(=O)C3=CSC(=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC2=[N+](C=C1Cl)C(=O)C=C(N2)COC(=O)C3=CSC(=C3)S(=O)(=O)N

InChI

InChI=1S/C14H10ClN3O5S2/c15-9-1-2-11-17-10(4-12(19)18(11)5-9)6-23-14(20)8-3-13(24-7-8)25(16,21)22/h1-5,7H,6H2,(H2,16,21,22)/p+1