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

Systemtic Name: 4-[[3-[2-ethenyl-6-[4-[4-(3-methylbutoxy)phenyl]butoxy]pyridin-3-yl]phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 2,2-diethyl-4-[3-[6-[4-(4-isopentyloxyphenyl)butoxy]-2-vinyl-3-pyridyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[3-[2-ethenyl-6-[4-[4-(3-methylbutoxy)phenyl]butoxy]-3-pyridinyl]anilino]-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-[3-[2-ethenyl-6-[4-[4-(3-methylbutoxy)phenyl]butoxy]pyridin-3-yl]anilino]-2,2-diethyl-4-oxobutanoic acid Traditional Name: 2,2-diethyl-4-[3-[6-[4-(4-isoamoxyphenyl)butoxy]-2-vinyl-3-pyridyl]anilino]-4-keto-butyric acid Formula: C36H46N2O5 MolecularWeight: 586.76084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)OCCCCC3=CC=C(C=C3)OCCC(C)C)C=C)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC=CC(=C1)C2=C(N=C(C=C2)OCCCCC3=CC=C(C=C3)OCCC(C)C)C=C)C(=O)O

InChI

InChI=1S/C36H46N2O5/c1-6-32-31(28-13-11-14-29(24-28)37-33(39)25-36(7-2,8-3)35(40)41)19-20-34(38-32)43-22-10-9-12-27-15-17-30(18-16-27)42-23-21-26(4)5/h6,11,13-20,24,26H,1,7-10,12,21-23,25H2,2-5H3,(H,37,39)(H,40,41)