ethyl 4-[2-(4-tert-butylphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzoate

Systemtic Name: ethyl 4-[2-(4-tert-butylphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzoate Openeye Name: ethyl 4-[2-(4-tert-butylphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzoate CAS Name: 4-[2-(4-tert-butylphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-tert-butylphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzoate Traditional Name: 4-[2-(4-tert-butylphenyl)-4-keto-1,2-dihydroquinazolin-3-yl]benzoic acid ethyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H28N2O3/c1-5-32-26(31)19-12-16-21(17-13-19)29-24(18-10-14-20(15-11-18)27(2,3)4)28-23-9-7-6-8-22(23)25(29)30/h6-17,24,28H,5H2,1-4H3