methyl 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoate

Systemtic Name: methyl 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoate Openeye Name: methyl 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoate CAS Name: 3-(2-cyano-3-methyl-2-phenylbutyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-cyano-3-methyl-2-phenylbutyl)benzoate Traditional Name: 3-(2-cyano-3-methyl-2-phenyl-butyl)benzoic acid methyl ester Formula: C20H21NO2 MolecularWeight: 307.38624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO2/c1-15(2)20(14-21,18-10-5-4-6-11-18)13-16-8-7-9-17(12-16)19(22)23-3/h4-12,15H,13H2,1-3H3