ethyl 2-[(1R,3S)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydro-1H-isoindol-1-yl]ethanoate

Systemtic Name: ethyl 2-[(1R,3S)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydro-1H-isoindol-1-yl]ethanoate Openeye Name: ethyl 2-[(1R,3S)-3-(2-ethoxy-2-oxo-ethyl)isoindolin-1-yl]acetate CAS Name: 2-[(1R,3S)-3-(2-ethoxy-2-oxoethyl)-2,3-dihydro-1H-isoindol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1R,3S)-3-(2-ethoxy-2-oxoethyl)-2,3-dihydro-1H-isoindol-1-yl]acetate Traditional Name: 2-[(1R,3S)-3-(2-ethoxy-2-keto-ethyl)isoindolin-1-yl]acetic acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C2=CC=CC=C2C(N1)CC(=O)OCC

Isomeric SMILES

CCOC(=O)C[C@@H]1C2=CC=CC=C2[C@@H](N1)CC(=O)OCC

InChI

InChI=1S/C16H21NO4/c1-3-20-15(18)9-13-11-7-5-6-8-12(11)14(17-13)10-16(19)21-4-2/h5-8,13-14,17H,3-4,9-10H2,1-2H3/t13-,14+