(4-carbamimidoylphenyl) 2-azanyl-4-chloranyl-benzoate hydrochloride

Systemtic Name: (4-carbamimidoylphenyl) 2-azanyl-4-chloranyl-benzoate hydrochloride Openeye Name: (4-carbamimidoylphenyl) 2-amino-4-chloro-benzoate hydrochloride CAS Name: 2-amino-4-chlorobenzoic acid (4-carbamimidoylphenyl) ester hydrochloride IUPAC Name: (4-carbamimidoylphenyl) 2-amino-4-chlorobenzoate hydrochloride Traditional Name: 2-amino-4-chloro-benzoic acid (4-amidinophenyl) ester hydrochloride Formula: C14H13Cl2N3O2 MolecularWeight: 326.17792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)OC(=O)C2=C(C=C(C=C2)Cl)N.Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)OC(=O)C2=C(C=C(C=C2)Cl)N.Cl

InChI

InChI=1S/C14H12ClN3O2.ClH/c15-9-3-6-11(12(16)7-9)14(19)20-10-4-1-8(2-5-10)13(17)18;/h1-7H,16H2,(H3,17,18);1H