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

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)amino]ethyl]phenoxy]acetic acid Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

InChI

InChI=1S/C18H19N3O4/c19-17(20)13-3-5-14(6-4-13)18(24)21-10-9-12-1-7-15(8-2-12)25-11-16(22)23/h1-8H,9-11H2,(H3,19,20)(H,21,24)(H,22,23)