2-ethylbutyl (6R)-3-methyl-4-oxidanylidene-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: 2-ethylbutyl (6R)-3-methyl-4-oxidanylidene-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: 2-ethylbutyl (6R)-3-methyl-4-oxo-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-3-methyl-4-oxo-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester IUPAC Name: 2-ethylbutyl (6R)-3-methyl-4-oxo-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-4-keto-3-methyl-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)COC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC(CC)COC(=O)C1=C(C2=C(N1)C[C@H](CC2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27NO3/c1-4-15(5-2)13-26-22(25)21-14(3)20-18(23-21)11-17(12-19(20)24)16-9-7-6-8-10-16/h6-10,15,17,23H,4-5,11-13H2,1-3H3/t17-/m1/s1