methyl 3-[6-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pyridin-3-yl]propanoate hydrochloride

Systemtic Name: methyl 3-[6-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pyridin-3-yl]propanoate hydrochloride Openeye Name: methyl 3-[6-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]-3-pyridyl]propanoate hydrochloride CAS Name: 3-[6-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-3-pyridinyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[6-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]pyridin-3-yl]propanoate hydrochloride Traditional Name: 3-[6-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]-3-pyridyl]propionic acid methyl ester hydrochloride Formula: C19H22ClN5O3 MolecularWeight: 403.86268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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