4-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-2-phenoxy-butanoic acid

Systemtic Name: 4-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-2-phenoxy-butanoic acid Openeye Name: 4-[(4-carbamimidoylbenzoyl)amino]-3-oxo-2-phenoxy-butanoic acid CAS Name: 4-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-oxo-2-phenoxybutanoic acid IUPAC Name: 4-[(4-carbamimidoylbenzoyl)amino]-3-oxo-2-phenoxybutanoic acid Traditional Name: 4-[(4-amidinobenzoyl)amino]-3-keto-2-phenoxy-butyric acid Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(C(=O)CNC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(C(=O)CNC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)O

InChI

InChI=1S/C18H17N3O5/c19-16(20)11-6-8-12(9-7-11)17(23)21-10-14(22)15(18(24)25)26-13-4-2-1-3-5-13/h1-9,15H,10H2,(H3,19,20)(H,21,23)(H,24,25)