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

Systemtic Name: [(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3-(ethoxymethyl)-4-methoxy-benzoate Openeye Name: [(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3-(ethoxymethyl)-4-methoxy-benzoate CAS Name: 3-(ethoxymethyl)-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-(ethoxymethyl)-4-methoxybenzoate Traditional Name: 3-(ethoxymethyl)-4-methoxy-benzoic acid [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)C(=O)OC(C)C2=NC(=O)C3=CC=CC=C3N2)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)C(=O)O[C@H](C)C2=NC(=O)C3=CC=CC=C3N2)OC

InChI

InChI=1S/C21H22N2O5/c1-4-27-12-15-11-14(9-10-18(15)26-3)21(25)28-13(2)19-22-17-8-6-5-7-16(17)20(24)23-19/h5-11,13H,4,12H2,1-3H3,(H,22,23,24)/t13-/m1/s1