butyl 1-(phenylcarbonyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate

Systemtic Name: butyl 1-(phenylcarbonyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate Openeye Name: butyl 1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate CAS Name: 1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid butyl ester IUPAC Name: butyl 1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate Traditional Name: 1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid butyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC2CCCCC2N1C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1CC2CCCCC2N1C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H27NO3/c1-2-3-13-24-20(23)18-14-16-11-7-8-12-17(16)21(18)19(22)15-9-5-4-6-10-15/h4-6,9-10,16-18H,2-3,7-8,11-14H2,1H3