(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: (6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid (6-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C16H12ClN3O4 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C16H12ClN3O4/c1-8(21)9-4-13(18-6-9)16(23)24-7-14-19-12-3-2-10(17)5-11(12)15(22)20-14/h2-6,18H,7H2,1H3,(H,19,20,22)