2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethoxy]phenyl]ethanoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)OCCNC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)OCCNC(=O)C2=CC=C(C=C2)C(=N)N

InChI

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