4-[2,2-bis(2-ethylphenyl)ethenyl]-6-(2-oxidanylideneethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid

Systemtic Name: 4-[2,2-bis(2-ethylphenyl)ethenyl]-6-(2-oxidanylideneethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid Openeye Name: 4-[2,2-bis(2-ethylphenyl)vinyl]-6-(2-oxoethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid CAS Name: 4-[2,2-bis(2-ethylphenyl)ethenyl]-6-(2-oxoethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid IUPAC Name: 4-[2,2-bis(2-ethylphenyl)ethenyl]-6-(2-oxoethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid Traditional Name: 4-[2,2-bis(2-ethylphenyl)vinyl]-6-(2-ketoethyl)-1,2,3,6-tetrahydropyridine-5-carboxylic acid Formula: C26H29NO3 MolecularWeight: 403.51336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(=CC2=C(C(NCC2)CC=O)C(=O)O)C3=CC=CC=C3CC

Isomeric SMILES

CCC1=CC=CC=C1C(=CC2=C(C(NCC2)CC=O)C(=O)O)C3=CC=CC=C3CC

InChI

InChI=1S/C26H29NO3/c1-3-18-9-5-7-11-21(18)23(22-12-8-6-10-19(22)4-2)17-20-13-15-27-24(14-16-28)25(20)26(29)30/h5-12,16-17,24,27H,3-4,13-15H2,1-2H3,(H,29,30)