2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanyl-propyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanyl-propyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-3-hydroxy-propyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-hydroxypropyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-3-hydroxypropyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)amino]-3-hydroxy-propyl]phenoxy]acetic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CO)NC(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC(CO)NC(=O)C2=CC=C(C=C2)C(=N)N)OCC(=O)O

InChI

InChI=1S/C19H21N3O5/c20-18(21)13-3-5-14(6-4-13)19(26)22-15(10-23)9-12-1-7-16(8-2-12)27-11-17(24)25/h1-8,15,23H,9-11H2,(H3,20,21)(H,22,26)(H,24,25)