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

Systemtic Name: 2-phenoxyethyl (6S)-3-methyl-4-oxidanylidene-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: 2-phenoxyethyl (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 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (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 2-phenoxyethyl ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=O)CC(C2)C3=CC=CS3)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC2=C1C(=O)C[C@H](C2)C3=CC=CS3)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C22H21NO4S/c1-14-20-17(12-15(13-18(20)24)19-8-5-11-28-19)23-21(14)22(25)27-10-9-26-16-6-3-2-4-7-16/h2-8,11,15,23H,9-10,12-13H2,1H3/t15-/m0/s1