(phenylmethyl) 1-[(2S)-2-bromanylpropanoyl]-2,3-dihydroindole-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[(2S)-2-bromanylpropanoyl]-2,3-dihydroindole-2-carboxylate Openeye Name: benzyl 1-[(2S)-2-bromopropanoyl]indoline-2-carboxylate CAS Name: 1-[(2S)-2-bromo-1-oxopropyl]-2,3-dihydroindole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[(2S)-2-bromopropanoyl]-2,3-dihydroindole-2-carboxylate Traditional Name: 1-[(2S)-2-bromopropanoyl]indoline-2-carboxylic acid benzyl ester Formula: C19H18BrNO3 MolecularWeight: 388.25512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C(CC2=CC=CC=C21)C(=O)OCC3=CC=CC=C3)Br

Isomeric SMILES

C[C@@H](C(=O)N1C(CC2=CC=CC=C21)C(=O)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C19H18BrNO3/c1-13(20)18(22)21-16-10-6-5-9-15(16)11-17(21)19(23)24-12-14-7-3-2-4-8-14/h2-10,13,17H,11-12H2,1H3/t13-,17?/m0/s1