methyl 4-[3-[2-(4-carbamimidoylphenyl)-2-oxidanyl-ethyl]-2-oxidanylidene-imidazolidin-1-yl]butanoate

Systemtic Name: methyl 4-[3-[2-(4-carbamimidoylphenyl)-2-oxidanyl-ethyl]-2-oxidanylidene-imidazolidin-1-yl]butanoate Openeye Name: methyl 4-[3-[2-(4-carbamimidoylphenyl)-2-hydroxy-ethyl]-2-oxo-imidazolidin-1-yl]butanoate CAS Name: 4-[3-[2-(4-carbamimidoylphenyl)-2-hydroxyethyl]-2-oxo-1-imidazolidinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(4-carbamimidoylphenyl)-2-hydroxyethyl]-2-oxoimidazolidin-1-yl]butanoate Traditional Name: 4-[3-[2-(4-amidinophenyl)-2-hydroxy-ethyl]-2-keto-imidazolidin-1-yl]butyric acid methyl ester Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1CCN(C1=O)CC(C2=CC=C(C=C2)C(=N)N)O

Isomeric SMILES

COC(=O)CCCN1CCN(C1=O)CC(C2=CC=C(C=C2)C(=N)N)O

InChI

InChI=1S/C17H24N4O4/c1-25-15(23)3-2-8-20-9-10-21(17(20)24)11-14(22)12-4-6-13(7-5-12)16(18)19/h4-7,14,22H,2-3,8-11H2,1H3,(H3,18,19)