(phenylmethyl) (2S)-2-(butylcarbamoyl)-2,3-dihydroindole-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(butylcarbamoyl)-2,3-dihydroindole-1-carboxylate Openeye Name: benzyl (2S)-2-(butylcarbamoyl)indoline-1-carboxylate CAS Name: (2S)-2-[butylamino(oxo)methyl]-2,3-dihydroindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(butylcarbamoyl)-2,3-dihydroindole-1-carboxylate Traditional Name: (2S)-2-(butylcarbamoyl)indoline-1-carboxylic acid benzyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC2=CC=CC=C2N1C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)[C@@H]1CC2=CC=CC=C2N1C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c1-2-3-13-22-20(24)19-14-17-11-7-8-12-18(17)23(19)21(25)26-15-16-9-5-4-6-10-16/h4-12,19H,2-3,13-15H2,1H3,(H,22,24)/t19-/m0/s1