ethyl 2-methyl-7-oxidanylidene-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylate

Systemtic Name: ethyl 2-methyl-7-oxidanylidene-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylate Openeye Name: ethyl 2-methyl-7-oxo-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylate CAS Name: 2-methyl-7-oxo-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-7-oxo-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylate Traditional Name: 7-keto-2-methyl-1,3,4,4a,5,6-hexahydroisoquinoline-4-carboxylic acid ethyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CC2=CC(=O)CCC12)C

Isomeric SMILES

CCOC(=O)C1CN(CC2=CC(=O)CCC12)C

InChI

InChI=1S/C13H19NO3/c1-3-17-13(16)12-8-14(2)7-9-6-10(15)4-5-11(9)12/h6,11-12H,3-5,7-8H2,1-2H3