3-cyano-4-methyl-2-(2-methylpropyl)naphthalene-1-carboxylic acid

Systemtic Name: 3-cyano-4-methyl-2-(2-methylpropyl)naphthalene-1-carboxylic acid Openeye Name: 3-cyano-2-isobutyl-4-methyl-naphthalene-1-carboxylic acid CAS Name: 3-cyano-4-methyl-2-(2-methylpropyl)-1-naphthalenecarboxylic acid IUPAC Name: 3-cyano-4-methyl-2-(2-methylpropyl)naphthalene-1-carboxylic acid Traditional Name: 3-cyano-2-isobutyl-4-methyl-1-naphthoic acid Formula: C17H17NO2 MolecularWeight: 267.32238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=CC=CC=C12)C(=O)O)CC(C)C)C#N

Isomeric SMILES

CC1=C(C(=C(C2=CC=CC=C12)C(=O)O)CC(C)C)C#N

InChI

InChI=1S/C17H17NO2/c1-10(2)8-14-15(9-18)11(3)12-6-4-5-7-13(12)16(14)17(19)20/h4-7,10H,8H2,1-3H3,(H,19,20)