3-(3-carbamimidoylphenyl)-5-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid Openeye Name: 3-(3-carbamimidoylphenyl)-5-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid CAS Name: 3-(3-carbamimidoylphenyl)-5-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid IUPAC Name: 3-(3-carbamimidoylphenyl)-5-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid Traditional Name: 3-(3-amidinophenyl)-5-[(2-methylolphenoxy)methyl]benzoic acid Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CO)OCC2=CC(=CC(=C2)C(=O)O)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C(=C1)CO)OCC2=CC(=CC(=C2)C(=O)O)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C22H20N2O4/c23-21(24)16-6-3-5-15(10-16)18-8-14(9-19(11-18)22(26)27)13-28-20-7-2-1-4-17(20)12-25/h1-11,25H,12-13H2,(H3,23,24)(H,26,27)