ethyl (2S,3R)-1-ethanoyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydroindole-2-carboxylate

Systemtic Name: ethyl (2S,3R)-1-ethanoyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydroindole-2-carboxylate Openeye Name: ethyl (2S,3R)-1-acetyl-3-(2-ethoxy-2-oxo-ethyl)indoline-2-carboxylate CAS Name: (2S,3R)-1-acetyl-3-(2-ethoxy-2-oxoethyl)-2,3-dihydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-1-acetyl-3-(2-ethoxy-2-oxoethyl)-2,3-dihydroindole-2-carboxylate Traditional Name: (2S,3R)-1-acetyl-3-(2-ethoxy-2-keto-ethyl)indoline-2-carboxylic acid ethyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(N(C2=CC=CC=C12)C(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C[C@H]1[C@H](N(C2=CC=CC=C12)C(=O)C)C(=O)OCC

InChI

InChI=1S/C17H21NO5/c1-4-22-15(20)10-13-12-8-6-7-9-14(12)18(11(3)19)16(13)17(21)23-5-2/h6-9,13,16H,4-5,10H2,1-3H3/t13-,16+/m1/s1