1-[2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]pentanoylamino]pentanoylamino]ethylphosphonic acid

Systemtic Name: 1-[2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]pentanoylamino]pentanoylamino]ethylphosphonic acid Openeye Name: 1-[2-[2-[[2-(benzyloxycarbonylamino)acetyl]amino]pentanoylamino]pentanoylamino]ethylphosphonic acid CAS Name: 1-[[1-oxo-2-[[1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]pentyl]amino]pentyl]amino]ethylphosphonic acid IUPAC Name: 1-[2-[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]pentanoylamino]pentanoylamino]ethylphosphonic acid Traditional Name: 1-[2-[2-[[2-(benzyloxycarbonylamino)acetyl]amino]pentanoylamino]pentanoylamino]ethylphosphonic acid Formula: C22H35N4O8P MolecularWeight: 514.509061

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CCC)C(=O)NC(C)P(=O)(O)O)NC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCC(C(=O)NC(CCC)C(=O)NC(C)P(=O)(O)O)NC(=O)CNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C22H35N4O8P/c1-4-9-17(21(29)26-18(10-5-2)20(28)24-15(3)35(31,32)33)25-19(27)13-23-22(30)34-14-16-11-7-6-8-12-16/h6-8,11-12,15,17-18H,4-5,9-10,13-14H2,1-3H3,(H,23,30)(H,24,28)(H,25,27)(H,26,29)(H2,31,32,33)