methyl 3a-(1,3-benzodioxol-5-yl)-5-oxidanyl-2-oxidanylidene-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylate

Systemtic Name: methyl 3a-(1,3-benzodioxol-5-yl)-5-oxidanyl-2-oxidanylidene-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylate Openeye Name: methyl 3a-(1,3-benzodioxol-5-yl)-5-hydroxy-2-oxo-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylate CAS Name: 3a-(1,3-benzodioxol-5-yl)-5-hydroxy-2-oxo-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylic acid methyl ester IUPAC Name: methyl 3a-(1,3-benzodioxol-5-yl)-5-hydroxy-2-oxo-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylate Traditional Name: 3a-(1,3-benzodioxol-5-yl)-5-hydroxy-2-keto-3,4,5,6,7,7a-hexahydro-1H-indole-3-carboxylic acid methyl ester Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)NC2C1(CC(CC2)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1C(=O)NC2C1(CC(CC2)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19NO6/c1-22-16(21)14-15(20)18-13-5-3-10(19)7-17(13,14)9-2-4-11-12(6-9)24-8-23-11/h2,4,6,10,13-14,19H,3,5,7-8H2,1H3,(H,18,20)