methyl 3-[(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzoate

Systemtic Name: methyl 3-[(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzoate Openeye Name: methyl 3-[(6-chloro-4-oxo-quinazolin-3-yl)methyl]benzoate CAS Name: 3-[(6-chloro-4-oxo-3-quinazolinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(6-chloro-4-oxoquinazolin-3-yl)methyl]benzoate Traditional Name: 3-[(6-chloro-4-keto-quinazolin-3-yl)methyl]benzoic acid methyl ester Formula: C17H13ClN2O3 MolecularWeight: 328.74972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN2O3/c1-23-17(22)12-4-2-3-11(7-12)9-20-10-19-15-6-5-13(18)8-14(15)16(20)21/h2-8,10H,9H2,1H3