2-oxidanylidene-3-pent-4-enyl-1-(phenylmethyl)piperidine-3-carboxylic acid

Systemtic Name: 2-oxidanylidene-3-pent-4-enyl-1-(phenylmethyl)piperidine-3-carboxylic acid Openeye Name: 1-benzyl-2-oxo-3-pent-4-enyl-piperidine-3-carboxylic acid CAS Name: 2-oxo-3-pent-4-enyl-1-(phenylmethyl)-3-piperidinecarboxylic acid IUPAC Name: 1-benzyl-2-oxo-3-pent-4-enylpiperidine-3-carboxylic acid Traditional Name: 1-benzyl-2-keto-3-pent-4-enyl-nipecotic acid Formula: C18H23NO3 MolecularWeight: 301.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC1(CCCN(C1=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C=CCCCC1(CCCN(C1=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H23NO3/c1-2-3-7-11-18(17(21)22)12-8-13-19(16(18)20)14-15-9-5-4-6-10-15/h2,4-6,9-10H,1,3,7-8,11-14H2,(H,21,22)