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

Systemtic Name: 2-ethylbutyl (6R)-6-(4-chlorophenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: 2-ethylbutyl (6R)-6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester IUPAC Name: 2-ethylbutyl (6R)-6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-6-(4-chlorophenyl)-4-keto-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester Formula: C22H26ClNO3 MolecularWeight: 387.89974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClNO3/c1-4-14(5-2)12-27-22(26)21-13(3)20-18(24-21)10-16(11-19(20)25)15-6-8-17(23)9-7-15/h6-9,14,16,24H,4-5,10-12H2,1-3H3/t16-/m1/s1