2-methoxycarbonyl-6-oxidanyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-methoxycarbonyl-6-oxidanyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 6-hydroxy-2-methoxycarbonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid CAS Name: 6-hydroxy-2-methoxycarbonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 6-hydroxy-2-methoxycarbonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-carbomethoxy-6-hydroxy-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxylic acid Formula: C12H19NO5 MolecularWeight: 257.28296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CC2CCC(CC2CC1C(=O)O)O

Isomeric SMILES

COC(=O)N1CC2CCC(CC2CC1C(=O)O)O

InChI

InChI=1S/C12H19NO5/c1-18-12(17)13-6-7-2-3-9(14)4-8(7)5-10(13)11(15)16/h7-10,14H,2-6H2,1H3,(H,15,16)