4-[2-[ethyl(pyridin-4-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[2-[ethyl(pyridin-4-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-[2-[ethyl(4-pyridyl)amino]-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[2-[ethyl(pyridin-4-yl)amino]-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[2-[ethyl(pyridin-4-yl)amino]-2-oxoethyl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-[2-[ethyl(4-pyridyl)amino]-2-keto-ethyl]-4-phenyl-piperidine-1-carboxylic acid Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=NC=C1)C(=O)CC2(CCN(CC2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC=NC=C1)C(=O)CC2(CCN(CC2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3/c1-2-24(18-8-12-22-13-9-18)19(25)16-21(17-6-4-3-5-7-17)10-14-23(15-11-21)20(26)27/h3-9,12-13H,2,10-11,14-16H2,1H3,(H,26,27)