(phenylmethyl) N-[1-azanyl-1,4-bis(oxidanylidene)-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-azanyl-1,4-bis(oxidanylidene)-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate Openeye Name: benzyl N-[6-amino-5-(benzyloxycarbonylamino)-3,6-dioxo-hexyl]carbamate CAS Name: N-[1-amino-1,4-dioxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-amino-1,4-dioxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamate Traditional Name: N-[6-amino-5-(benzyloxycarbonylamino)-3,6-diketo-hexyl]carbamic acid benzyl ester Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O6/c23-20(27)19(25-22(29)31-15-17-9-5-2-6-10-17)13-18(26)11-12-24-21(28)30-14-16-7-3-1-4-8-16/h1-10,19H,11-15H2,(H2,23,27)(H,24,28)(H,25,29)