(E)-3-[4-[[2-(4-hydroxyphenyl)-3-methyl-5-oxidanyl-indol-1-yl]methyl]phenyl]-2-pyrrolidin-1-yl-prop-2-enamide

Systemtic Name: (E)-3-[4-[[2-(4-hydroxyphenyl)-3-methyl-5-oxidanyl-indol-1-yl]methyl]phenyl]-2-pyrrolidin-1-yl-prop-2-enamide Openeye Name: (E)-3-[4-[[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-indol-1-yl]methyl]phenyl]-2-pyrrolidin-1-yl-prop-2-enamide CAS Name: (E)-3-[4-[[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-1-indolyl]methyl]phenyl]-2-(1-pyrrolidinyl)-2-propenamide IUPAC Name: (E)-3-[4-[[5-hydroxy-2-(4-hydroxyphenyl)-3-methylindol-1-yl]methyl]phenyl]-2-pyrrolidin-1-ylprop-2-enamide Traditional Name: (E)-3-[4-[[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-indol-1-yl]methyl]phenyl]-2-pyrrolidino-acrylamide Formula: C29H29N3O3 MolecularWeight: 467.55886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)C=C(C(=O)N)N4CCCC4)C5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)/C=C(\C(=O)N)/N4CCCC4)C5=CC=C(C=C5)O

InChI

InChI=1S/C29H29N3O3/c1-19-25-17-24(34)12-13-26(25)32(28(19)22-8-10-23(33)11-9-22)18-21-6-4-20(5-7-21)16-27(29(30)35)31-14-2-3-15-31/h4-13,16-17,33-34H,2-3,14-15,18H2,1H3,(H2,30,35)/b27-16+