2-[4-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethoxy]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethoxy]methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxo-ethoxy]methyl]phenoxy]acetic acid CAS Name: 2-[4-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethoxy]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethoxy]methyl]phenoxy]acetic acid Traditional Name: 2-[4-[[2-[(4-amidinobenzyl)amino]-2-keto-ethoxy]methyl]phenoxy]acetic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COCC2=CC=C(C=C2)OCC(=O)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COCC2=CC=C(C=C2)OCC(=O)O)C(=N)N

InChI

InChI=1S/C19H21N3O5/c20-19(21)15-5-1-13(2-6-15)9-22-17(23)11-26-10-14-3-7-16(8-4-14)27-12-18(24)25/h1-8H,9-12H2,(H3,20,21)(H,22,23)(H,24,25)