propan-2-yl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate Openeye Name: isopropyl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxo-quinazoline-6-carboxylate CAS Name: 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxo-6-quinazolinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxoquinazoline-6-carboxylate Traditional Name: 3-(2-chlorophenyl)-4-keto-5,7-dimethyl-2-methylol-quinazoline-6-carboxylic acid isopropyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C(=O)OC(C)C)C)C(=O)N(C(=N2)CO)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC2=C(C(=C1C(=O)OC(C)C)C)C(=O)N(C(=N2)CO)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H21ClN2O4/c1-11(2)28-21(27)18-12(3)9-15-19(13(18)4)20(26)24(17(10-25)23-15)16-8-6-5-7-14(16)22/h5-9,11,25H,10H2,1-4H3