tert-butyl 3-[[6-(4-fluoranylphenoxy)-2-(2-methylphenyl)-4-oxidanylidene-quinazolin-3-yl]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[6-(4-fluoranylphenoxy)-2-(2-methylphenyl)-4-oxidanylidene-quinazolin-3-yl]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[6-(4-fluorophenoxy)-2-(o-tolyl)-4-oxo-quinazolin-3-yl]methyl]piperidine-1-carboxylate CAS Name: 3-[[6-(4-fluorophenoxy)-2-(2-methylphenyl)-4-oxo-3-quinazolinyl]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[6-(4-fluorophenoxy)-2-(2-methylphenyl)-4-oxoquinazolin-3-yl]methyl]piperidine-1-carboxylate Traditional Name: 3-[[6-(4-fluorophenoxy)-4-keto-2-(o-tolyl)quinazolin-3-yl]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H34FN3O4 MolecularWeight: 543.628463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)OC4=CC=C(C=C4)F)C(=O)N2CC5CCCN(C5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)OC4=CC=C(C=C4)F)C(=O)N2CC5CCCN(C5)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H34FN3O4/c1-21-8-5-6-10-26(21)29-34-28-16-15-25(39-24-13-11-23(33)12-14-24)18-27(28)30(37)36(29)20-22-9-7-17-35(19-22)31(38)40-32(2,3)4/h5-6,8,10-16,18,22H,7,9,17,19-20H2,1-4H3