2,3-dimethoxy-6-[(2S)-4-oxidanylidene-3-phenyl-1,2-dihydroquinazolin-2-yl]benzoic acid

Systemtic Name: 2,3-dimethoxy-6-[(2S)-4-oxidanylidene-3-phenyl-1,2-dihydroquinazolin-2-yl]benzoic acid Openeye Name: 2,3-dimethoxy-6-[(2S)-4-oxo-3-phenyl-1,2-dihydroquinazolin-2-yl]benzoic acid CAS Name: 2,3-dimethoxy-6-[(2S)-4-oxo-3-phenyl-1,2-dihydroquinazolin-2-yl]benzoic acid IUPAC Name: 2,3-dimethoxy-6-[(2S)-4-oxo-3-phenyl-1,2-dihydroquinazolin-2-yl]benzoic acid Traditional Name: 6-[(2S)-4-keto-3-phenyl-1,2-dihydroquinazolin-2-yl]-2,3-dimethoxy-benzoic acid Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H]2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(=O)O)OC

InChI

InChI=1S/C23H20N2O5/c1-29-18-13-12-16(19(23(27)28)20(18)30-2)21-24-17-11-7-6-10-15(17)22(26)25(21)14-8-4-3-5-9-14/h3-13,21,24H,1-2H3,(H,27,28)/t21-/m0/s1