4-[[3-[2-ethenyl-6-(6-phenylhexyl)pyridin-3-yl]phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[2-ethenyl-6-(6-phenylhexyl)pyridin-3-yl]phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 2,2-diethyl-4-oxo-4-[3-[6-(6-phenylhexyl)-2-vinyl-3-pyridyl]anilino]butanoic acid CAS Name: 4-[3-[2-ethenyl-6-(6-phenylhexyl)-3-pyridinyl]anilino]-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-[3-[2-ethenyl-6-(6-phenylhexyl)pyridin-3-yl]anilino]-2,2-diethyl-4-oxobutanoic acid Traditional Name: 2,2-diethyl-4-keto-4-[3-[6-(6-phenylhexyl)-2-vinyl-3-pyridyl]anilino]butyric acid Formula: C33H40N2O3 MolecularWeight: 512.6823

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)CCCCCCC3=CC=CC=C3)C=C)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)CCCCCCC3=CC=CC=C3)C=C)C(=O)O

InChI

InChI=1S/C33H40N2O3/c1-4-30-29(22-21-27(34-30)19-13-8-7-10-15-25-16-11-9-12-17-25)26-18-14-20-28(23-26)35-31(36)24-33(5-2,6-3)32(37)38/h4,9,11-12,14,16-18,20-23H,1,5-8,10,13,15,19,24H2,2-3H3,(H,35,36)(H,37,38)