[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3-ethoxy-4-methoxy-benzoate

Systemtic Name: [(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3-ethoxy-4-methoxy-benzoate Openeye Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3-ethoxy-4-methoxy-benzoate CAS Name: 3-ethoxy-4-methoxybenzoic acid [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3-ethoxy-4-methoxybenzoate Traditional Name: 3-ethoxy-4-methoxy-benzoic acid [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC(C)C2=NC(=O)C3=CC=CC=C3N2)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)O[C@H](C)C2=NC(=O)C3=CC=CC=C3N2)OC

InChI

InChI=1S/C20H20N2O5/c1-4-26-17-11-13(9-10-16(17)25-3)20(24)27-12(2)18-21-15-8-6-5-7-14(15)19(23)22-18/h5-12H,4H2,1-3H3,(H,21,22,23)/t12-/m1/s1