3-[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]propanoic acid hydrochloride

Systemtic Name: 3-[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoylamino]propanoic acid hydrochloride Openeye Name: 3-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]acetyl]amino]propanoic acid hydrochloride CAS Name: 3-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydroisoxazol-5-yl]-1-oxoethyl]amino]propanoic acid hydrochloride IUPAC Name: 3-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]propanoic acid hydrochloride Traditional Name: 3-[[2-[3-(4-amidinophenyl)-2-isoxazolin-5-yl]acetyl]amino]propionic acid hydrochloride Formula: C15H19ClN4O4 MolecularWeight: 354.78876

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=C(C=C2)C(=N)N)CC(=O)NCCC(=O)O.Cl

Isomeric SMILES

C1C(ON=C1C2=CC=C(C=C2)C(=N)N)CC(=O)NCCC(=O)O.Cl

InChI

InChI=1S/C15H18N4O4.ClH/c16-15(17)10-3-1-9(2-4-10)12-7-11(23-19-12)8-13(20)18-6-5-14(21)22;/h1-4,11H,5-8H2,(H3,16,17)(H,18,20)(H,21,22);1H