methyl 4-(2-acetyloxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate

Systemtic Name: methyl 4-(2-acetyloxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Openeye Name: methyl 4-(2-acetoxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate CAS Name: 4-(2-acetyloxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-acetyloxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Traditional Name: 4-(2-acetoxy-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC=C(C=C4)C(=O)OC)OC(=O)C)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC=C(C=C4)C(=O)OC)OC(=O)C)OC

InChI

InChI=1S/C26H29NO6/c1-5-32-24-13-19-20-12-18(33-15(2)28)10-11-22(20)27-25(21(19)14-23(24)30-3)16-6-8-17(9-7-16)26(29)31-4/h6-9,13-14,18,20,22H,5,10-12H2,1-4H3