methyl 5-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pentanoate hydrochloride

Systemtic Name: methyl 5-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pentanoate hydrochloride Openeye Name: methyl 5-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]pentanoate hydrochloride CAS Name: 5-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]pentanoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]pentanoate hydrochloride Traditional Name: 5-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]valeric acid methyl ester hydrochloride Formula: C16H23ClN4O3 MolecularWeight: 354.83182

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C16H22N4O3.ClH/c1-23-14(21)4-2-3-9-19-10-11-20(16(19)22)13-7-5-12(6-8-13)15(17)18;/h5-8H,2-4,9-11H2,1H3,(H3,17,18);1H