[(E)-N'-[(4-carboxyphenyl)carbamoyl]carbamimidoyl]azanium chloride

Systemtic Name: [(E)-N'-[(4-carboxyphenyl)carbamoyl]carbamimidoyl]azanium chloride Openeye Name: [(E)-N'-[(4-carboxyphenyl)carbamoyl]carbamimidoyl]ammonium chloride CAS Name: [(E)-amino-[(4-carboxyanilino)-oxomethyl]iminomethyl]ammonium chloride IUPAC Name: [(E)-N'-[(4-carboxyphenyl)carbamoyl]carbamimidoyl]azanium chloride Traditional Name: [(E)-N'-[(4-carboxyphenyl)carbamoyl]amidino]ammonium chloride Formula: C9H11ClN4O3 MolecularWeight: 258.66164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)N=C([NH3+])N.[Cl-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)/N=C(/[NH3+])\N.[Cl-]

InChI

InChI=1S/C9H10N4O3.ClH/c10-8(11)13-9(16)12-6-3-1-5(2-4-6)7(14)15;/h1-4H,(H,14,15)(H5,10,11,12,13,16);1H