3-cyano-3-cyclohexyl-3-phenyl-propanoic acid

Systemtic Name: 3-cyano-3-cyclohexyl-3-phenyl-propanoic acid Openeye Name: 3-cyano-3-cyclohexyl-3-phenyl-propanoic acid CAS Name: 3-cyano-3-cyclohexyl-3-phenylpropanoic acid IUPAC Name: 3-cyano-3-cyclohexyl-3-phenylpropanoic acid Traditional Name: 3-cyano-3-cyclohexyl-3-phenyl-propionic acid Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)(C#N)C2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H19NO2/c17-12-16(11-15(18)19,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1,3-4,7-8,14H,2,5-6,9-11H2,(H,18,19)