[(4-carbamimidoylphenyl)-(phenylmethoxycarbonylamino)methyl]-phenoxy-phosphinic acid

Systemtic Name: [(4-carbamimidoylphenyl)-(phenylmethoxycarbonylamino)methyl]-phenoxy-phosphinic acid Openeye Name: [benzyloxycarbonylamino-(4-carbamimidoylphenyl)methyl]-phenoxy-phosphinic acid CAS Name: [(4-carbamimidoylphenyl)-(phenylmethoxycarbonylamino)methyl]-phenoxyphosphinic acid IUPAC Name: [(4-carbamimidoylphenyl)-(phenylmethoxycarbonylamino)methyl]-phenoxyphosphinic acid Traditional Name: [(4-amidinophenyl)-(benzyloxycarbonylamino)methyl]-phenoxy-phosphinic acid Formula: C22H22N3O5P MolecularWeight: 439.400941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)C(=N)N)P(=O)(O)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)C(=N)N)P(=O)(O)OC3=CC=CC=C3

InChI

InChI=1S/C22H22N3O5P/c23-20(24)17-11-13-18(14-12-17)21(31(27,28)30-19-9-5-2-6-10-19)25-22(26)29-15-16-7-3-1-4-8-16/h1-14,21H,15H2,(H3,23,24)(H,25,26)(H,27,28)