1-[(R)-cyano-(3-ethoxyphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(R)-cyano-(3-ethoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(R)-cyano-(3-ethoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(R)-cyano-(3-ethoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(R)-cyano-(3-ethoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(R)-cyano(m-phenetyl)methyl]isonipecotic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C#N)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)[C@H](C#N)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-2-21-14-5-3-4-13(10-14)15(11-17)18-8-6-12(7-9-18)16(19)20/h3-5,10,12,15H,2,6-9H2,1H3,(H,19,20)/t15-/m0/s1