2-[4-[2-[(4-carbamimidoylphenyl)carbonyl-methyl-amino]ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)carbonyl-methyl-amino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)-methyl-amino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]-methylamino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)-methylamino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)-methyl-amino]ethyl]phenoxy]acetic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=C(C=C1)OCC(=O)O)C(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CN(CCC1=CC=C(C=C1)OCC(=O)O)C(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H21N3O4/c1-22(19(25)15-6-4-14(5-7-15)18(20)21)11-10-13-2-8-16(9-3-13)26-12-17(23)24/h2-9H,10-12H2,1H3,(H3,20,21)(H,23,24)