[4-[[[3-(aminomethyl)phenyl]methyl-phenylmethoxycarbonyl-amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[[3-(aminomethyl)phenyl]methyl-phenylmethoxycarbonyl-amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[[3-(aminomethyl)phenyl]methyl-benzyloxycarbonyl-amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[[3-(aminomethyl)phenyl]methyl-phenylmethoxycarbonylamino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[[3-(aminomethyl)phenyl]methyl-phenylmethoxycarbonylamino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[[3-(aminomethyl)benzyl]-carbobenzoxy-amino]methyl]benzyl]phosphonic acid Formula: C24H27N2O5P MolecularWeight: 454.455341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CC2=CC=C(C=C2)CP(=O)(O)O)CC3=CC=CC(=C3)CN

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CC2=CC=C(C=C2)CP(=O)(O)O)CC3=CC=CC(=C3)CN

InChI

InChI=1S/C24H27N2O5P/c25-14-22-7-4-8-23(13-22)16-26(24(27)31-17-20-5-2-1-3-6-20)15-19-9-11-21(12-10-19)18-32(28,29)30/h1-13H,14-18,25H2,(H2,28,29,30)