[[(4-carbamimidoylphenyl)amino]-(3,4-diethoxyphenyl)methyl]-phenylmethoxy-phosphinic acid

Systemtic Name: [[(4-carbamimidoylphenyl)amino]-(3,4-diethoxyphenyl)methyl]-phenylmethoxy-phosphinic acid Openeye Name: benzyloxy-[(4-carbamimidoylanilino)-(3,4-diethoxyphenyl)methyl]phosphinic acid CAS Name: [(4-carbamimidoylanilino)-(3,4-diethoxyphenyl)methyl]-phenylmethoxyphosphinic acid IUPAC Name: [(4-carbamimidoylanilino)-(3,4-diethoxyphenyl)methyl]-phenylmethoxyphosphinic acid Traditional Name: [(4-amidinoanilino)-(3,4-diethoxyphenyl)methyl]-benzoxy-phosphinic acid Formula: C25H30N3O5P MolecularWeight: 483.496561

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(NC2=CC=C(C=C2)C(=N)N)P(=O)(O)OCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(NC2=CC=C(C=C2)C(=N)N)P(=O)(O)OCC3=CC=CC=C3)OCC

InChI

InChI=1S/C25H30N3O5P/c1-3-31-22-15-12-20(16-23(22)32-4-2)25(28-21-13-10-19(11-14-21)24(26)27)34(29,30)33-17-18-8-6-5-7-9-18/h5-16,25,28H,3-4,17H2,1-2H3,(H3,26,27)(H,29,30)