methyl (6aR,7S,10R,10aS)-7,10-diacetyloxy-5-methyl-6-oxidanylidene-7,10-dihydro-6aH-phenanthridine-10a-carboxylate

Systemtic Name: methyl (6aR,7S,10R,10aS)-7,10-diacetyloxy-5-methyl-6-oxidanylidene-7,10-dihydro-6aH-phenanthridine-10a-carboxylate Openeye Name: methyl (6aR,7S,10R,10aS)-7,10-diacetoxy-5-methyl-6-oxo-7,10-dihydro-6aH-phenanthridine-10a-carboxylate CAS Name: (6aR,7S,10R,10aS)-7,10-diacetyloxy-5-methyl-6-oxo-7,10-dihydro-6aH-phenanthridine-10a-carboxylic acid methyl ester IUPAC Name: methyl (6aR,7S,10R,10aS)-7,10-diacetyloxy-5-methyl-6-oxo-7,10-dihydro-6aH-phenanthridine-10a-carboxylate Traditional Name: (6aR,7S,10R,10aS)-7,10-diacetoxy-6-keto-5-methyl-7,10-dihydro-6aH-phenanthridine-10a-carboxylic acid methyl ester Formula: C20H21NO7 MolecularWeight: 387.38324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC(C2(C1C(=O)N(C3=CC=CC=C32)C)C(=O)OC)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1C=C[C@H]([C@@]2([C@H]1C(=O)N(C3=CC=CC=C32)C)C(=O)OC)OC(=O)C

InChI

InChI=1S/C20H21NO7/c1-11(22)27-15-9-10-16(28-12(2)23)20(19(25)26-4)13-7-5-6-8-14(13)21(3)18(24)17(15)20/h5-10,15-17H,1-4H3/t15-,16+,17+,20-/m0/s1