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

Systemtic Name: 2,6-dimethyl-4-[3-(oxiran-2-ylmethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-[3-(oxiran-2-ylmethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-4-[3-(2-oxiranylmethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-[3-(oxiran-2-ylmethoxy)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-glycidoxyphenyl)-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(=CC=C2)OCC3CO3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)OCC3CO3)C(=O)O

InChI

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