propan-2-yl 4-[[4-(3-chlorophenyl)-2-ethoxy-quinazolin-6-yl]-(3-methylimidazol-4-yl)-oxidanyl-methyl]benzoate

Systemtic Name: propan-2-yl 4-[[4-(3-chlorophenyl)-2-ethoxy-quinazolin-6-yl]-(3-methylimidazol-4-yl)-oxidanyl-methyl]benzoate Openeye Name: isopropyl 4-[[4-(3-chlorophenyl)-2-ethoxy-quinazolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]benzoate CAS Name: 4-[[4-(3-chlorophenyl)-2-ethoxy-6-quinazolinyl]-hydroxy-(3-methyl-4-imidazolyl)methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-(3-chlorophenyl)-2-ethoxyquinazolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]benzoate Traditional Name: 4-[[4-(3-chlorophenyl)-2-ethoxy-quinazolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]benzoic acid isopropyl ester Formula: C31H29ClN4O4 MolecularWeight: 557.03936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C=C(C=C2)C(C3=CC=C(C=C3)C(=O)OC(C)C)(C4=CN=CN4C)O)C(=N1)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCOC1=NC2=C(C=C(C=C2)C(C3=CC=C(C=C3)C(=O)OC(C)C)(C4=CN=CN4C)O)C(=N1)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H29ClN4O4/c1-5-39-30-34-26-14-13-23(16-25(26)28(35-30)21-7-6-8-24(32)15-21)31(38,27-17-33-18-36(27)4)22-11-9-20(10-12-22)29(37)40-19(2)3/h6-19,38H,5H2,1-4H3