2-[3-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]phenoxy]ethanoic acid Openeye Name: 2-[3-[(4-carbamimidoylbenzoyl)carbamoylamino]phenoxy]acetic acid CAS Name: 2-[3-[[[[(4-carbamimidoylphenyl)-oxomethyl]amino]-oxomethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[3-[(4-carbamimidoylbenzoyl)carbamoylamino]phenoxy]acetic acid Traditional Name: 2-[3-[(4-amidinobenzoyl)carbamoylamino]phenoxy]acetic acid Formula: C17H16N4O5 MolecularWeight: 356.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O5/c18-15(19)10-4-6-11(7-5-10)16(24)21-17(25)20-12-2-1-3-13(8-12)26-9-14(22)23/h1-8H,9H2,(H3,18,19)(H,22,23)(H2,20,21,24,25)