[2-(3,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] 4-tert-butylcyclohexane-1-carboxylate

Systemtic Name: [2-(3,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] 4-tert-butylcyclohexane-1-carboxylate Openeye Name: [2-(3,5-dimethoxyphenyl)-4-oxo-quinazolin-3-yl] 4-tert-butylcyclohexanecarboxylate CAS Name: 4-tert-butyl-1-cyclohexanecarboxylic acid [2-(3,5-dimethoxyphenyl)-4-oxo-3-quinazolinyl] ester IUPAC Name: [2-(3,5-dimethoxyphenyl)-4-oxoquinazolin-3-yl] 4-tert-butylcyclohexane-1-carboxylate Traditional Name: 4-tert-butylcyclohexanecarboxylic acid [2-(3,5-dimethoxyphenyl)-4-keto-quinazolin-3-yl] ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C27H32N2O5/c1-27(2,3)19-12-10-17(11-13-19)26(31)34-29-24(18-14-20(32-4)16-21(15-18)33-5)28-23-9-7-6-8-22(23)25(29)30/h6-9,14-17,19H,10-13H2,1-5H3