4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-[4-(2-carboxyethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=C(C=C2)CCC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=C(C=C2)CCC(=O)O)C(=O)O

InChI

InChI=1S/C18H19NO6/c1-9-14(17(22)23)16(15(18(24)25)10(2)19-9)12-6-3-11(4-7-12)5-8-13(20)21/h3-4,6-7,16,19H,5,8H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)