3-cyano-2-ethyl-naphthalene-1-carboxylic acid

Systemtic Name: 3-cyano-2-ethyl-naphthalene-1-carboxylic acid Openeye Name: 3-cyano-2-ethyl-naphthalene-1-carboxylic acid CAS Name: 3-cyano-2-ethyl-1-naphthalenecarboxylic acid IUPAC Name: 3-cyano-2-ethylnaphthalene-1-carboxylic acid Traditional Name: 3-cyano-2-ethyl-1-naphthoic acid Formula: C14H11NO2 MolecularWeight: 225.24264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2C=C1C#N)C(=O)O

Isomeric SMILES

CCC1=C(C2=CC=CC=C2C=C1C#N)C(=O)O

InChI

InChI=1S/C14H11NO2/c1-2-11-10(8-15)7-9-5-3-4-6-12(9)13(11)14(16)17/h3-7H,2H2,1H3,(H,16,17)