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

Systemtic Name: pentyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxidanylidene-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: pentyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylic acid pentyl ester IUPAC Name: pentyl (6R)-6-(4-methoxyphenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-4-keto-6-(4-methoxyphenyl)-3-methyl-1,5,6,7-tetrahydroindole-2-carboxylic acid amyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCCCCOC(=O)C1=C(C2=C(N1)C[C@H](CC2=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H27NO4/c1-4-5-6-11-27-22(25)21-14(2)20-18(23-21)12-16(13-19(20)24)15-7-9-17(26-3)10-8-15/h7-10,16,23H,4-6,11-13H2,1-3H3/t16-/m1/s1