2-[2-(phenylmethoxycarbonylamino)butanoyl]-1,3-dihydroisoindole-1-carboxylic acid

Systemtic Name: 2-[2-(phenylmethoxycarbonylamino)butanoyl]-1,3-dihydroisoindole-1-carboxylic acid Openeye Name: 2-[2-(benzyloxycarbonylamino)butanoyl]isoindoline-1-carboxylic acid CAS Name: 2-[1-oxo-2-(phenylmethoxycarbonylamino)butyl]-1,3-dihydroisoindole-1-carboxylic acid IUPAC Name: 2-[2-(phenylmethoxycarbonylamino)butanoyl]-1,3-dihydroisoindole-1-carboxylic acid Traditional Name: 2-[2-(benzyloxycarbonylamino)butanoyl]isoindoline-1-carboxylic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CC2=CC=CC=C2C1C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)N1CC2=CC=CC=C2C1C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5/c1-2-17(22-21(27)28-13-14-8-4-3-5-9-14)19(24)23-12-15-10-6-7-11-16(15)18(23)20(25)26/h3-11,17-18H,2,12-13H2,1H3,(H,22,27)(H,25,26)