[4-[[(4-azanylcyclohexyl)-phenylmethoxycarbonyl-amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[(4-azanylcyclohexyl)-phenylmethoxycarbonyl-amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[(4-aminocyclohexyl)-benzyloxycarbonyl-amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[(4-aminocyclohexyl)-phenylmethoxycarbonylamino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[(4-aminocyclohexyl)-phenylmethoxycarbonylamino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[(4-aminocyclohexyl)-carbobenzoxy-amino]methyl]benzyl]phosphonic acid Formula: C22H29N2O5P MolecularWeight: 432.449821

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)CP(=O)(O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)CP(=O)(O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H29N2O5P/c23-20-10-12-21(13-11-20)24(22(25)29-15-18-4-2-1-3-5-18)14-17-6-8-19(9-7-17)16-30(26,27)28/h1-9,20-21H,10-16,23H2,(H2,26,27,28)