3-(2-ethoxy-2-oxidanylidene-ethyl)-3-methyl-1H-isoindole-2-carboxylic acid

Systemtic Name: 3-(2-ethoxy-2-oxidanylidene-ethyl)-3-methyl-1H-isoindole-2-carboxylic acid Openeye Name: 1-(2-ethoxy-2-oxo-ethyl)-1-methyl-isoindoline-2-carboxylic acid CAS Name: 3-(2-ethoxy-2-oxoethyl)-3-methyl-1H-isoindole-2-carboxylic acid IUPAC Name: 3-(2-ethoxy-2-oxoethyl)-3-methyl-1H-isoindole-2-carboxylic acid Traditional Name: 1-(2-ethoxy-2-keto-ethyl)-1-methyl-isoindoline-2-carboxylic acid Formula: C14H17NO4 MolecularWeight: 263.28908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(C2=CC=CC=C2CN1C(=O)O)C

Isomeric SMILES

CCOC(=O)CC1(C2=CC=CC=C2CN1C(=O)O)C

InChI

InChI=1S/C14H17NO4/c1-3-19-12(16)8-14(2)11-7-5-4-6-10(11)9-15(14)13(17)18/h4-7H,3,8-9H2,1-2H3,(H,17,18)