5-(3-cyanophenoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-(3-cyanophenoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-(3-cyanophenoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-[(3-cyanophenoxy)-oxomethyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-(3-cyanophenoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-(3-cyanophenoxy)carbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1)C)C(=O)OC2=CC=CC(=C2)C#N)C(=O)O

Isomeric SMILES

CC1=C(CC(=C(N1)C)C(=O)OC2=CC=CC(=C2)C#N)C(=O)O

InChI

InChI=1S/C16H14N2O4/c1-9-13(15(19)20)7-14(10(2)18-9)16(21)22-12-5-3-4-11(6-12)8-17/h3-6,18H,7H2,1-2H3,(H,19,20)