3-(2-cyano-3-methyl-2-phenyl-butyl)benzoic acid

Systemtic Name: 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoic acid Openeye Name: 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoic acid CAS Name: 3-(2-cyano-3-methyl-2-phenylbutyl)benzoic acid IUPAC Name: 3-(2-cyano-3-methyl-2-phenylbutyl)benzoic acid Traditional Name: 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoic acid Formula: C19H19NO2 MolecularWeight: 293.35966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC=CC(=C1)C(=O)O)(C#N)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(CC1=CC=CC(=C1)C(=O)O)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C19H19NO2/c1-14(2)19(13-20,17-9-4-3-5-10-17)12-15-7-6-8-16(11-15)18(21)22/h3-11,14H,12H2,1-2H3,(H,21,22)