(phenylmethyl) N-[3-[3,6-bis(phenylmethoxycarbonylamino)hexanoylamino]propyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[3,6-bis(phenylmethoxycarbonylamino)hexanoylamino]propyl]carbamate Openeye Name: benzyl N-[4-(benzyloxycarbonylamino)-1-[2-[3-(benzyloxycarbonylamino)propylamino]-2-oxo-ethyl]butyl]carbamate CAS Name: N-[3-[[1-oxo-3,6-bis(phenylmethoxycarbonylamino)hexyl]amino]propyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[3,6-bis(phenylmethoxycarbonylamino)hexanoylamino]propyl]carbamate Traditional Name: N-[4-(benzyloxycarbonylamino)-1-[2-[3-(benzyloxycarbonylamino)propylamino]-2-keto-ethyl]butyl]carbamic acid benzyl ester Formula: C33H40N4O7 MolecularWeight: 604.6933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCC(CC(=O)NCCCNC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCC(CC(=O)NCCCNC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C33H40N4O7/c38-30(34-20-11-21-36-32(40)43-24-27-14-6-2-7-15-27)22-29(37-33(41)44-25-28-16-8-3-9-17-28)18-10-19-35-31(39)42-23-26-12-4-1-5-13-26/h1-9,12-17,29H,10-11,18-25H2,(H,34,38)(H,35,39)(H,36,40)(H,37,41)