[[(4-carbamimidoylphenyl)amino]-(3-methoxy-4-phenylmethoxy-phenyl)methyl]-methoxy-phosphinic acid

Systemtic Name: [[(4-carbamimidoylphenyl)amino]-(3-methoxy-4-phenylmethoxy-phenyl)methyl]-methoxy-phosphinic acid Openeye Name: [(4-benzyloxy-3-methoxy-phenyl)-(4-carbamimidoylanilino)methyl]-methoxy-phosphinic acid CAS Name: [(4-carbamimidoylanilino)-(3-methoxy-4-phenylmethoxyphenyl)methyl]-methoxyphosphinic acid IUPAC Name: [(4-carbamimidoylanilino)-(3-methoxy-4-phenylmethoxyphenyl)methyl]-methoxyphosphinic acid Traditional Name: [(4-amidinoanilino)-(4-benzoxy-3-methoxy-phenyl)methyl]-methoxy-phosphinic acid Formula: C23H26N3O5P MolecularWeight: 455.443401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(NC2=CC=C(C=C2)C(=N)N)P(=O)(O)OC)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(NC2=CC=C(C=C2)C(=N)N)P(=O)(O)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N3O5P/c1-29-21-14-18(10-13-20(21)31-15-16-6-4-3-5-7-16)23(32(27,28)30-2)26-19-11-8-17(9-12-19)22(24)25/h3-14,23,26H,15H2,1-2H3,(H3,24,25)(H,27,28)