[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3,4-dipropoxybenzoate

Systemtic Name: [(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3,4-dipropoxybenzoate Openeye Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3,4-dipropoxybenzoate CAS Name: 3,4-dipropoxybenzoic acid [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3,4-dipropoxybenzoate Traditional Name: 3,4-dipropoxybenzoic acid [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C2=NC(=O)C3=CC=CC=C3N2)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)O[C@H](C)C2=NC(=O)C3=CC=CC=C3N2)OCCC

InChI

InChI=1S/C23H26N2O5/c1-4-12-28-19-11-10-16(14-20(19)29-13-5-2)23(27)30-15(3)21-24-18-9-7-6-8-17(18)22(26)25-21/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,24,25,26)/t15-/m1/s1