ethyl 2-(hydroxymethyl)-3-(4-methoxyphenyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate hydrochloride

Systemtic Name: ethyl 2-(hydroxymethyl)-3-(4-methoxyphenyl)-5,7-dimethyl-4-oxidanylidene-quinazoline-6-carboxylate hydrochloride Openeye Name: ethyl 2-(hydroxymethyl)-3-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-quinazoline-6-carboxylate hydrochloride CAS Name: 2-(hydroxymethyl)-3-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-6-quinazolinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-(hydroxymethyl)-3-(4-methoxyphenyl)-5,7-dimethyl-4-oxoquinazoline-6-carboxylate hydrochloride Traditional Name: 4-keto-3-(4-methoxyphenyl)-5,7-dimethyl-2-methylol-quinazoline-6-carboxylic acid ethyl ester hydrochloride Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C1C)N=C(N(C2=O)C3=CC=C(C=C3)OC)CO)C.Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C1C)N=C(N(C2=O)C3=CC=C(C=C3)OC)CO)C.Cl

InChI

InChI=1S/C21H22N2O5.ClH/c1-5-28-21(26)18-12(2)10-16-19(13(18)3)20(25)23(17(11-24)22-16)14-6-8-15(27-4)9-7-14;/h6-10,24H,5,11H2,1-4H3;1H