2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethyl methyl carbonate hydrochloride

Systemtic Name: 2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethyl methyl carbonate hydrochloride Openeye Name: 2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]ethyl methyl carbonate hydrochloride CAS Name: carbonic acid 2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]ethyl methyl ester hydrochloride IUPAC Name: 2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]ethyl methyl carbonate hydrochloride Traditional Name: carbonic acid 2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]ethyl methyl ester hydrochloride Formula: C14H19ClN4O4 MolecularWeight: 342.77806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

COC(=O)OCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C14H18N4O4.ClH/c1-21-14(20)22-9-8-17-6-7-18(13(17)19)11-4-2-10(3-5-11)12(15)16;/h2-5H,6-9H2,1H3,(H3,15,16);1H