methyl 4-(8,9-dimethoxy-2-oxidanyl-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate

Systemtic Name: methyl 4-(8,9-dimethoxy-2-oxidanyl-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Openeye Name: methyl 4-(2-hydroxy-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate CAS Name: 4-(2-hydroxy-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-hydroxy-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Traditional Name: 4-(2-hydroxy-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC=C(C=C4)C(=O)OC)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC=C(C=C4)C(=O)OC)O)OC

InChI

InChI=1S/C23H25NO5/c1-27-20-11-16-17-10-15(25)8-9-19(17)24-22(18(16)12-21(20)28-2)13-4-6-14(7-5-13)23(26)29-3/h4-7,11-12,15,17,19,25H,8-10H2,1-3H3