6-[(2S)-3-cyclopropyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxy-benzoate

Systemtic Name: 6-[(2S)-3-cyclopropyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxy-benzoate Openeye Name: 6-[(2S)-3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxy-benzoate CAS Name: 6-[(2S)-3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxybenzoate IUPAC Name: 6-[(2S)-3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxybenzoate Traditional Name: 6-[(2S)-3-cyclopropyl-4-keto-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxy-benzoate Formula: C20H19N2O5- MolecularWeight: 367.37526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4CC4)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H]2NC3=CC=CC=C3C(=O)N2C4CC4)C(=O)[O-])OC

InChI

InChI=1S/C20H20N2O5/c1-26-15-10-9-13(16(20(24)25)17(15)27-2)18-21-14-6-4-3-5-12(14)19(23)22(18)11-7-8-11/h3-6,9-11,18,21H,7-8H2,1-2H3,(H,24,25)/p-1/t18-/m0/s1