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

Systemtic Name: 4-[[3-[6-[4-[2-(cyclobutylmethoxy)phenyl]butoxymethyl]-2-ethenyl-pyridin-3-yl]phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[6-[4-[2-(cyclobutylmethoxy)phenyl]butoxymethyl]-2-vinyl-3-pyridyl]anilino]-2,2-diethyl-4-oxo-butanoic acid CAS Name: 4-[3-[6-[4-[2-(cyclobutylmethoxy)phenyl]butoxymethyl]-2-ethenyl-3-pyridinyl]anilino]-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-[3-[6-[4-[2-(cyclobutylmethoxy)phenyl]butoxymethyl]-2-ethenylpyridin-3-yl]anilino]-2,2-diethyl-4-oxobutanoic acid Traditional Name: 4-[3-[6-[4-[2-(cyclobutylmethoxy)phenyl]butoxymethyl]-2-vinyl-3-pyridyl]anilino]-2,2-diethyl-4-keto-butyric acid Formula: C37H46N2O5 MolecularWeight: 598.77154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)COCCCCC3=CC=CC=C3OCC4CCC4)C=C)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)COCCCCC3=CC=CC=C3OCC4CCC4)C=C)C(=O)O

InChI

InChI=1S/C37H46N2O5/c1-4-33-32(29-17-12-18-30(23-29)39-35(40)24-37(5-2,6-3)36(41)42)21-20-31(38-33)26-43-22-10-9-16-28-15-7-8-19-34(28)44-25-27-13-11-14-27/h4,7-8,12,15,17-21,23,27H,1,5-6,9-11,13-14,16,22,24-26H2,2-3H3,(H,39,40)(H,41,42)