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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO3/c1-4-7-17-20-18(23-21(17)22(25)26-6-3)12-16(13-19(20)24)15-10-8-14(5-2)9-11-15/h8-11,16,23H,4-7,12-13H2,1-3H3/t16-/m1/s1