(phenylmethyl) N-[(5S)-5-azanyl-6-(1,3-dihydroisoindol-2-yl)-6-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[(5S)-5-azanyl-6-(1,3-dihydroisoindol-2-yl)-6-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-[(5S)-5-amino-6-isoindolin-2-yl-6-oxo-hexyl]carbamate CAS Name: N-[(5S)-5-amino-6-(1,3-dihydroisoindol-2-yl)-6-oxohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(5S)-5-amino-6-(1,3-dihydroisoindol-2-yl)-6-oxohexyl]carbamate Traditional Name: N-[(5S)-5-amino-6-isoindolin-2-yl-6-keto-hexyl]carbamic acid benzyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C(=O)C(CCCCNC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

C1C2=CC=CC=C2CN1C(=O)[C@H](CCCCNC(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C22H27N3O3/c23-20(21(26)25-14-18-10-4-5-11-19(18)15-25)12-6-7-13-24-22(27)28-16-17-8-2-1-3-9-17/h1-5,8-11,20H,6-7,12-16,23H2,(H,24,27)/t20-/m0/s1