[1-[[6-azanyl-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-phenyl-ethyl]phosphonic acid

Systemtic Name: [1-[[6-azanyl-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-phenyl-ethyl]phosphonic acid Openeye Name: [1-[[6-amino-2-(benzyloxycarbonylamino)hexanoyl]amino]-2-phenyl-ethyl]phosphonic acid CAS Name: [1-[[6-amino-1-oxo-2-(phenylmethoxycarbonylamino)hexyl]amino]-2-phenylethyl]phosphonic acid IUPAC Name: [1-[[6-amino-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-2-phenylethyl]phosphonic acid Traditional Name: [1-[[6-amino-2-(benzyloxycarbonylamino)hexanoyl]amino]-2-phenyl-ethyl]phosphonic acid Formula: C22H30N3O6P MolecularWeight: 463.463861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(NC(=O)C(CCCCN)NC(=O)OCC2=CC=CC=C2)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(NC(=O)C(CCCCN)NC(=O)OCC2=CC=CC=C2)P(=O)(O)O

InChI

InChI=1S/C22H30N3O6P/c23-14-8-7-13-19(24-22(27)31-16-18-11-5-2-6-12-18)21(26)25-20(32(28,29)30)15-17-9-3-1-4-10-17/h1-6,9-12,19-20H,7-8,13-16,23H2,(H,24,27)(H,25,26)(H2,28,29,30)