4-cyano-2-(naphthalen-1-ylmethyl)butanoic acid

Systemtic Name: 4-cyano-2-(naphthalen-1-ylmethyl)butanoic acid Openeye Name: 4-cyano-2-(1-naphthylmethyl)butanoic acid CAS Name: 4-cyano-2-(1-naphthalenylmethyl)butanoic acid IUPAC Name: 4-cyano-2-(naphthalen-1-ylmethyl)butanoic acid Traditional Name: 4-cyano-2-(1-naphthylmethyl)butyric acid Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(CCC#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(CCC#N)C(=O)O

InChI

InChI=1S/C16H15NO2/c17-10-4-8-14(16(18)19)11-13-7-3-6-12-5-1-2-9-15(12)13/h1-3,5-7,9,14H,4,8,11H2,(H,18,19)