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

Systemtic Name: butyl 3-(2-chlorophenyl)-2-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O4/c1-4-5-10-29-22(28)19-13(2)11-16-20(14(19)3)21(27)25(18(12-26)24-16)17-9-7-6-8-15(17)23/h6-9,11,26H,4-5,10,12H2,1-3H3