methyl 1-oxidanylidene-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylate

Systemtic Name: methyl 1-oxidanylidene-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylate Openeye Name: methyl 1-oxo-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylate CAS Name: 1-oxo-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 1-oxo-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylate Traditional Name: 1-keto-3,4,4a,5,6,8a-hexahydro-2H-isoquinoline-3-carboxylic acid methyl ester Formula: C11H15NO3 MolecularWeight: 209.2417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2CCC=CC2C(=O)N1

Isomeric SMILES

COC(=O)C1CC2CCC=CC2C(=O)N1

InChI

InChI=1S/C11H15NO3/c1-15-11(14)9-6-7-4-2-3-5-8(7)10(13)12-9/h3,5,7-9H,2,4,6H2,1H3,(H,12,13)