[6-(4-acetyloxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] ethanoate

Systemtic Name: [6-(4-acetyloxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] ethanoate Openeye Name: [6-(4-acetoxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] acetate CAS Name: acetic acid [6-(4-acetyloxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] ester IUPAC Name: [6-(4-acetyloxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] acetate Traditional Name: acetic acid [6-(4-acetoxyphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-yl] ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC2C(C1)C3=CC(=C(C=C3C(=N2)C4=CC=C(C=C4)OC(=O)C)OC)OC

Isomeric SMILES

CC(=O)OC1CCC2C(C1)C3=CC(=C(C=C3C(=N2)C4=CC=C(C=C4)OC(=O)C)OC)OC

InChI

InChI=1S/C25H27NO6/c1-14(27)31-17-7-5-16(6-8-17)25-21-13-24(30-4)23(29-3)12-19(21)20-11-18(32-15(2)28)9-10-22(20)26-25/h5-8,12-13,18,20,22H,9-11H2,1-4H3