ethyl (4aR,8aR)-7-oxidanylidene-4a-pyrrolidin-1-ylcarbonyl-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl (4aR,8aR)-7-oxidanylidene-4a-pyrrolidin-1-ylcarbonyl-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl (4aR,8aR)-7-oxo-4a-(pyrrolidine-1-carbonyl)-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylate CAS Name: (4aR,8aR)-7-oxo-4a-[oxo(1-pyrrolidinyl)methyl]-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl (4aR,8aR)-7-oxo-4a-(pyrrolidine-1-carbonyl)-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylate Traditional Name: (4aR,8aR)-7-keto-4a-(pyrrolidine-1-carbonyl)-3,4,8,8a-tetrahydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2(C=CC(=O)CC2C1)C(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)N1CC[C@]2(C=CC(=O)C[C@H]2C1)C(=O)N3CCCC3

InChI

InChI=1S/C17H24N2O4/c1-2-23-16(22)19-10-7-17(15(21)18-8-3-4-9-18)6-5-14(20)11-13(17)12-19/h5-6,13H,2-4,7-12H2,1H3/t13-,17-/m0/s1