ethyl 2-[4-[2-[4-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]methyl]phenyl]-3-[3-(4-methylphenyl)propyl]-4-oxidanylidene-azetidin-1-yl]phenoxy]-2-methyl-propanoate

Systemtic Name: ethyl 2-[4-[2-[4-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]methyl]phenyl]-3-[3-(4-methylphenyl)propyl]-4-oxidanylidene-azetidin-1-yl]phenoxy]-2-methyl-propanoate Openeye Name: ethyl 2-methyl-2-[4-[2-oxo-3-[3-(p-tolyl)propyl]-4-[4-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]methyl]phenyl]azetidin-1-yl]phenoxy]propanoate CAS Name: 2-methyl-2-[4-[3-[3-(4-methylphenyl)propyl]-2-oxo-4-[4-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]methyl]phenyl]-1-azetidinyl]phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-2-[4-[3-[3-(4-methylphenyl)propyl]-2-oxo-4-[4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]methyl]phenyl]azetidin-1-yl]phenoxy]propanoate Traditional Name: 2-[4-[2-keto-3-[3-(p-tolyl)propyl]-4-[4-[(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)methyl]phenyl]azetidin-1-yl]phenoxy]-2-methyl-propionic acid ethyl ester Formula: C38H47NO9 MolecularWeight: 661.78108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)OC1=CC=C(C=C1)N2C(C(C2=O)CCCC3=CC=C(C=C3)C)C4=CC=C(C=C4)CC5C(C(C(C(O5)CO)O)O)O

Isomeric SMILES

CCOC(=O)C(C)(C)OC1=CC=C(C=C1)N2C(C(C2=O)CCCC3=CC=C(C=C3)C)C4=CC=C(C=C4)CC5C(C(C(C(O5)CO)O)O)O

InChI

InChI=1S/C38H47NO9/c1-5-46-37(45)38(3,4)48-28-19-17-27(18-20-28)39-32(29(36(39)44)8-6-7-24-11-9-23(2)10-12-24)26-15-13-25(14-16-26)21-30-33(41)35(43)34(42)31(22-40)47-30/h9-20,29-35,40-43H,5-8,21-22H2,1-4H3