2-diethylaminoethyl 4-[(6,7-dimethoxyquinazolin-4-yl)amino]benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-[(6,7-dimethoxyquinazolin-4-yl)amino]benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[(6,7-dimethoxyquinazolin-4-yl)amino]benzoate hydrochloride CAS Name: 4-[(6,7-dimethoxy-4-quinazolinyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[(6,7-dimethoxyquinazolin-4-yl)amino]benzoate hydrochloride Traditional Name: 4-[(6,7-dimethoxyquinazolin-4-yl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C23H29ClN4O4 MolecularWeight: 460.95376

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OC.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OC.Cl

InChI

InChI=1S/C23H28N4O4.ClH/c1-5-27(6-2)11-12-31-23(28)16-7-9-17(10-8-16)26-22-18-13-20(29-3)21(30-4)14-19(18)24-15-25-22;/h7-10,13-15H,5-6,11-12H2,1-4H3,(H,24,25,26);1H