5-cyano-2-(3-methoxyphenyl)pentanoic acid

Systemtic Name: 5-cyano-2-(3-methoxyphenyl)pentanoic acid Openeye Name: 5-cyano-2-(3-methoxyphenyl)pentanoic acid CAS Name: 5-cyano-2-(3-methoxyphenyl)pentanoic acid IUPAC Name: 5-cyano-2-(3-methoxyphenyl)pentanoic acid Traditional Name: 5-cyano-2-(3-methoxyphenyl)valeric acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CCCC#N)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(CCCC#N)C(=O)O

InChI

InChI=1S/C13H15NO3/c1-17-11-6-4-5-10(9-11)12(13(15)16)7-2-3-8-14/h4-6,9,12H,2-3,7H2,1H3,(H,15,16)