2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]-1-oxidanyl-ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]-1-oxidanyl-ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-1-hydroxy-ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-hydroxyethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-1-hydroxyethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)amino]-1-hydroxy-ethyl]phenoxy]acetic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CNC(=O)C2=CC=C(C=C2)C(=N)N)O)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(CNC(=O)C2=CC=C(C=C2)C(=N)N)O)OCC(=O)O

InChI

InChI=1S/C18H19N3O5/c19-17(20)12-1-3-13(4-2-12)18(25)21-9-15(22)11-5-7-14(8-6-11)26-10-16(23)24/h1-8,15,22H,9-10H2,(H3,19,20)(H,21,25)(H,23,24)