(4-methylcyclohexyl) (6R)-6-(4-tert-butylphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: (4-methylcyclohexyl) (6R)-6-(4-tert-butylphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: (4-methylcyclohexyl) (6R)-6-(4-tert-butylphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(4-tert-butylphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) (6R)-6-(4-tert-butylphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-6-(4-tert-butylphenyl)-4-keto-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid (4-methylcyclohexyl) ester Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)C2=C(C3=C(N2)CC(CC3=O)C4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CC1CCC(CC1)OC(=O)C2=C(C3=C(N2)C[C@H](CC3=O)C4=CC=C(C=C4)C(C)(C)C)C

InChI

InChI=1S/C27H35NO3/c1-16-6-12-21(13-7-16)31-26(30)25-17(2)24-22(28-25)14-19(15-23(24)29)18-8-10-20(11-9-18)27(3,4)5/h8-11,16,19,21,28H,6-7,12-15H2,1-5H3/t16?,19-,21?/m1/s1