methyl 4-[6-[2-(4-chlorophenyl)-4-oxidanylidene-quinazolin-3-yl]hexoxy]benzoate

Systemtic Name: methyl 4-[6-[2-(4-chlorophenyl)-4-oxidanylidene-quinazolin-3-yl]hexoxy]benzoate Openeye Name: methyl 4-[6-[2-(4-chlorophenyl)-4-oxo-quinazolin-3-yl]hexoxy]benzoate CAS Name: 4-[6-[2-(4-chlorophenyl)-4-oxo-3-quinazolinyl]hexoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[6-[2-(4-chlorophenyl)-4-oxoquinazolin-3-yl]hexoxy]benzoate Traditional Name: 4-[6-[2-(4-chlorophenyl)-4-keto-quinazolin-3-yl]hexoxy]benzoic acid methyl ester Formula: C28H27ClN2O4 MolecularWeight: 490.97798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H27ClN2O4/c1-34-28(33)21-12-16-23(17-13-21)35-19-7-3-2-6-18-31-26(20-10-14-22(29)15-11-20)30-25-9-5-4-8-24(25)27(31)32/h4-5,8-17H,2-3,6-7,18-19H2,1H3