(phenylmethyl) N-[(2S)-1-azanyl-1-oxidanylidene-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-azanyl-1-oxidanylidene-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate Openeye Name: benzyl N-[(5S)-6-amino-5-(benzyloxycarbonylamino)-6-oxo-hexyl]carbamate CAS Name: N-[(2S)-1-amino-1-oxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-amino-1-oxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate Traditional Name: N-[(5S)-6-amino-5-(benzyloxycarbonylamino)-6-keto-hexyl]carbamic acid benzyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCC(C(=O)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCC[C@@H](C(=O)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O5/c23-20(26)19(25-22(28)30-16-18-11-5-2-6-12-18)13-7-8-14-24-21(27)29-15-17-9-3-1-4-10-17/h1-6,9-12,19H,7-8,13-16H2,(H2,23,26)(H,24,27)(H,25,28)/t19-/m0/s1