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

Systemtic Name: 4-[[3-[2-ethenyl-6-[4-(3-methyl-4-oxidanyl-phenyl)pentoxy]pyridin-3-yl]phenyl]amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 2,2-diethyl-4-[3-[6-[4-(4-hydroxy-3-methyl-phenyl)pentoxy]-2-vinyl-3-pyridyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[3-[2-ethenyl-6-[4-(4-hydroxy-3-methylphenyl)pentoxy]-3-pyridinyl]anilino]-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-[3-[2-ethenyl-6-[4-(4-hydroxy-3-methylphenyl)pentoxy]pyridin-3-yl]anilino]-2,2-diethyl-4-oxobutanoic acid Traditional Name: 2,2-diethyl-4-[3-[6-[4-(4-hydroxy-3-methyl-phenyl)pentoxy]-2-vinyl-3-pyridyl]anilino]-4-keto-butyric acid Formula: C33H40N2O5 MolecularWeight: 544.6811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H40N2O5/c1-6-28-27(25-12-9-13-26(20-25)34-30(37)21-33(7-2,8-3)32(38)39)15-17-31(35-28)40-18-10-11-22(4)24-14-16-29(36)23(5)19-24/h6,9,12-17,19-20,22,36H,1,7-8,10-11,18,21H2,2-5H3,(H,34,37)(H,38,39)