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

Systemtic Name: 2-ethylbutyl (6R)-3-methyl-4-oxidanylidene-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: 2-ethylbutyl (6R)-3-methyl-4-oxo-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6R)-3-methyl-4-oxo-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester IUPAC Name: 2-ethylbutyl (6R)-3-methyl-4-oxo-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6R)-4-keto-3-methyl-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylic acid 2-ethylbutyl ester Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)COC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C

Isomeric SMILES

CCC(CC)COC(=O)C1=C(C2=C(N1)C[C@H](CC2=O)C3=CC=CS3)C

InChI

InChI=1S/C20H25NO3S/c1-4-13(5-2)11-24-20(23)19-12(3)18-15(21-19)9-14(10-16(18)22)17-7-6-8-25-17/h6-8,13-14,21H,4-5,9-11H2,1-3H3/t14-/m1/s1