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

Systemtic Name: ethyl 3-methyl-4-oxidanylidene-1,3a,5,6,7,7a-hexahydroindole-2-carboxylate Openeye Name: ethyl 3-methyl-4-oxo-1,3a,5,6,7,7a-hexahydroindole-2-carboxylate CAS Name: 3-methyl-4-oxo-1,3a,5,6,7,7a-hexahydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-oxo-1,3a,5,6,7,7a-hexahydroindole-2-carboxylate Traditional Name: 4-keto-3-methyl-1,3a,5,6,7,7a-hexahydroindole-2-carboxylic acid ethyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2C(N1)CCCC2=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2C(N1)CCCC2=O)C

InChI

InChI=1S/C12H17NO3/c1-3-16-12(15)11-7(2)10-8(13-11)5-4-6-9(10)14/h8,10,13H,3-6H2,1-2H3