methyl 4-[5-[2-(4-carbamimidoylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-imidazolidin-1-yl]butanoate hydrochloride

Systemtic Name: methyl 4-[5-[2-(4-carbamimidoylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-imidazolidin-1-yl]butanoate hydrochloride Openeye Name: methyl 4-[5-[2-(4-carbamimidoylphenyl)-2-oxo-ethyl]-2-oxo-imidazolidin-1-yl]butanoate hydrochloride CAS Name: 4-[5-[2-(4-carbamimidoylphenyl)-2-oxoethyl]-2-oxo-1-imidazolidinyl]butanoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[5-[2-(4-carbamimidoylphenyl)-2-oxoethyl]-2-oxoimidazolidin-1-yl]butanoate hydrochloride Traditional Name: 4-[5-[2-(4-amidinophenyl)-2-keto-ethyl]-2-keto-imidazolidin-1-yl]butyric acid methyl ester hydrochloride Formula: C17H23ClN4O4 MolecularWeight: 382.84192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C(CNC1=O)CC(=O)C2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCCN1C(CNC1=O)CC(=O)C2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C17H22N4O4.ClH/c1-25-15(23)3-2-8-21-13(10-20-17(21)24)9-14(22)11-4-6-12(7-5-11)16(18)19;/h4-7,13H,2-3,8-10H2,1H3,(H3,18,19)(H,20,24);1H