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

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanyl-propanoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-3-hydroxy-propanoyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-hydroxy-1-oxopropyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]-3-hydroxypropanoyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)amino]-3-hydroxy-propanoyl]phenoxy]acetic acid Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)C(=O)NC(CO)C(=O)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)C(=O)NC(CO)C(=O)C2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C19H19N3O6/c20-18(21)12-1-3-13(4-2-12)19(27)22-15(9-23)17(26)11-5-7-14(8-6-11)28-10-16(24)25/h1-8,15,23H,9-10H2,(H3,20,21)(H,22,27)(H,24,25)