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

Systemtic Name: propyl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C2=C(C=C1C)N=C(N(C2=O)C3=CC=CC=C3Cl)CO)C

Isomeric SMILES

CCCOC(=O)C1=C(C2=C(C=C1C)N=C(N(C2=O)C3=CC=CC=C3Cl)CO)C

InChI

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