benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: benzene; 2-methyl-4-phenyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1)C(=O)O)C2=CC=CC=C2)C(=O)O.C1=CC=CC=C1

Isomeric SMILES

CC1=C(C(C(=CN1)C(=O)O)C2=CC=CC=C2)C(=O)O.C1=CC=CC=C1

InChI

InChI=1S/C14H13NO4.C6H6/c1-8-11(14(18)19)12(9-5-3-2-4-6-9)10(7-15-8)13(16)17;1-2-4-6-5-3-1/h2-7,12,15H,1H3,(H,16,17)(H,18,19);1-6H