methyl 3-[4-[3-(5-carbamimidoylpyridin-2-yl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate hydrochloride

Systemtic Name: methyl 3-[4-[3-(5-carbamimidoylpyridin-2-yl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate hydrochloride Openeye Name: methyl 3-[4-[3-(5-carbamimidoyl-2-pyridyl)-2-oxo-imidazolidin-1-yl]phenyl]propanoate hydrochloride CAS Name: 3-[4-[3-(5-carbamimidoyl-2-pyridinyl)-2-oxo-1-imidazolidinyl]phenyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[4-[3-(5-carbamimidoylpyridin-2-yl)-2-oxoimidazolidin-1-yl]phenyl]propanoate hydrochloride Traditional Name: 3-[4-[3-(5-amidino-2-pyridyl)-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester hydrochloride Formula: C19H22ClN5O3 MolecularWeight: 403.86268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=NC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2CCN(C2=O)C3=NC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C19H21N5O3.ClH/c1-27-17(25)9-4-13-2-6-15(7-3-13)23-10-11-24(19(23)26)16-8-5-14(12-22-16)18(20)21;/h2-3,5-8,12H,4,9-11H2,1H3,(H3,20,21);1H