[2-(3,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] 4-butoxybenzoate

Systemtic Name: [2-(3,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-3-yl] 4-butoxybenzoate Openeye Name: [2-(3,5-dimethoxyphenyl)-4-oxo-quinazolin-3-yl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-(3,5-dimethoxyphenyl)-4-oxo-3-quinazolinyl] ester IUPAC Name: [2-(3,5-dimethoxyphenyl)-4-oxoquinazolin-3-yl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-(3,5-dimethoxyphenyl)-4-keto-quinazolin-3-yl] ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)ON2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C27H26N2O6/c1-4-5-14-34-20-12-10-18(11-13-20)27(31)35-29-25(19-15-21(32-2)17-22(16-19)33-3)28-24-9-7-6-8-23(24)26(29)30/h6-13,15-17H,4-5,14H2,1-3H3