methyl 4-oxidanylidene-2-[(3-pyrrol-1-ylphenyl)carbonyloxymethyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[(3-pyrrol-1-ylphenyl)carbonyloxymethyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[(3-pyrrol-1-ylbenzoyl)oxymethyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[oxo-[3-(1-pyrrolyl)phenyl]methoxy]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[(3-pyrrol-1-ylbenzoyl)oxymethyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[(3-pyrrol-1-ylbenzoyl)oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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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(=CC=C3)N4C=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C22H17N3O5/c1-29-21(27)15-7-8-17-18(12-15)23-19(24-20(17)26)13-30-22(28)14-5-4-6-16(11-14)25-9-2-3-10-25/h2-12H,13H2,1H3,(H,23,24,26)