3-cyano-2-(2-methylpropyl)naphthalene-1-carboxylic acid

Systemtic Name: 3-cyano-2-(2-methylpropyl)naphthalene-1-carboxylic acid Openeye Name: 3-cyano-2-isobutyl-naphthalene-1-carboxylic acid CAS Name: 3-cyano-2-(2-methylpropyl)-1-naphthalenecarboxylic acid IUPAC Name: 3-cyano-2-(2-methylpropyl)naphthalene-1-carboxylic acid Traditional Name: 3-cyano-2-isobutyl-1-naphthoic acid Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=CC=CC=C2C=C1C#N)C(=O)O

Isomeric SMILES

CC(C)CC1=C(C2=CC=CC=C2C=C1C#N)C(=O)O

InChI

InChI=1S/C16H15NO2/c1-10(2)7-14-12(9-17)8-11-5-3-4-6-13(11)15(14)16(18)19/h3-6,8,10H,7H2,1-2H3,(H,18,19)