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

Systemtic Name: pentyl (6S)-3-methyl-4-oxidanylidene-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: pentyl (6S)-3-methyl-4-oxo-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: (6S)-3-methyl-4-oxo-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylic acid pentyl ester IUPAC Name: pentyl (6S)-3-methyl-4-oxo-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: (6S)-4-keto-3-methyl-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylic acid amyl ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO3S/c1-3-4-5-8-23-19(22)18-12(2)17-14(20-18)10-13(11-15(17)21)16-7-6-9-24-16/h6-7,9,13,20H,3-5,8,10-11H2,1-2H3/t13-/m0/s1