5-methyl-2-pyrrolidin-1-yl-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hept-6-en-2-ol

Systemtic Name: 5-methyl-2-pyrrolidin-1-yl-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hept-6-en-2-ol Openeye Name: 5-methyl-2-pyrrolidin-1-yl-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hept-6-en-2-ol CAS Name: 5-methyl-2-(1-pyrrolidinyl)-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-6-hepten-2-ol IUPAC Name: 5-methyl-2-pyrrolidin-1-yl-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hept-6-en-2-ol Traditional Name: 5-methyl-2-pyrrolidino-1-[3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hept-6-en-2-ol Formula: C29H40N2O5 MolecularWeight: 496.6383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CN1C(COC2=CC=CC=C21)C3=CC(=C(C(=C3)OC)OC)OC)(N4CCCC4)O)C=C

Isomeric SMILES

CC(CCC(CN1C(COC2=CC=CC=C21)C3=CC(=C(C(=C3)OC)OC)OC)(N4CCCC4)O)C=C

InChI

InChI=1S/C29H40N2O5/c1-6-21(2)13-14-29(32,30-15-9-10-16-30)20-31-23-11-7-8-12-25(23)36-19-24(31)22-17-26(33-3)28(35-5)27(18-22)34-4/h6-8,11-12,17-18,21,24,32H,1,9-10,13-16,19-20H2,2-5H3