N-[(E)-3-(3-carbamimidoylphenyl)prop-2-enyl]-2-oxidanyl-ethanamide dihydrochloride

Systemtic Name: N-[(E)-3-(3-carbamimidoylphenyl)prop-2-enyl]-2-oxidanyl-ethanamide dihydrochloride Openeye Name: N-[(E)-3-(3-carbamimidoylphenyl)allyl]-2-hydroxy-acetamide dihydrochloride CAS Name: N-[(E)-3-(3-carbamimidoylphenyl)prop-2-enyl]-2-hydroxyacetamide dihydrochloride IUPAC Name: N-[(E)-3-(3-carbamimidoylphenyl)prop-2-enyl]-2-hydroxyacetamide dihydrochloride Traditional Name: N-[(E)-3-(3-amidinophenyl)allyl]-2-hydroxy-acetamide dihydrochloride Formula: C12H17Cl2N3O2 MolecularWeight: 306.18828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=N)N)C=CCNC(=O)CO.Cl.Cl

Isomeric SMILES

C1=CC(=CC(=C1)C(=N)N)/C=C/CNC(=O)CO.Cl.Cl

InChI

InChI=1S/C12H15N3O2.2ClH/c13-12(14)10-5-1-3-9(7-10)4-2-6-15-11(17)8-16;;/h1-5,7,16H,6,8H2,(H3,13,14)(H,15,17);2*1H/b4-2+;;