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

Systemtic Name: ethyl (6R)-6-(4-tert-butylphenyl)-4-oxidanylidene-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: ethyl (6R)-6-(4-tert-butylphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(4-tert-butylphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-6-(4-tert-butylphenyl)-4-oxo-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-6-(4-tert-butylphenyl)-4-keto-3-propyl-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC2=C1C(=O)CC(C2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC2=C1C(=O)C[C@@H](C2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C24H31NO3/c1-6-8-18-21-19(25-22(18)23(27)28-7-2)13-16(14-20(21)26)15-9-11-17(12-10-15)24(3,4)5/h9-12,16,25H,6-8,13-14H2,1-5H3/t16-/m1/s1