4-(2,1,3-benzoxadiazol-4-yl)-6-methyl-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2,1,3-benzoxadiazol-4-yl)-6-methyl-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Openeye Name: 4-(2,1,3-benzoxadiazol-4-yl)-2-hydroxy-6-methyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid CAS Name: 4-(2,1,3-benzoxadiazol-4-yl)-2-hydroxy-6-methyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2,1,3-benzoxadiazol-4-yl)-2-hydroxy-6-methyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Traditional Name: 4-benzofurazan-4-yl-2-hydroxy-6-methyl-2-phenyl-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C(N1)(C2=CC=CC=C2)O)C(=O)O)C3=CC=CC4=NON=C43)C(=O)O

Isomeric SMILES

CC1=C(C(C(C(N1)(C2=CC=CC=C2)O)C(=O)O)C3=CC=CC4=NON=C43)C(=O)O

InChI

InChI=1S/C20H17N3O6/c1-10-14(18(24)25)15(12-8-5-9-13-17(12)23-29-22-13)16(19(26)27)20(28,21-10)11-6-3-2-4-7-11/h2-9,15-16,21,28H,1H3,(H,24,25)(H,26,27)