dimethyl 3-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]pentanedioate

Systemtic Name: dimethyl 3-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]pentanedioate Openeye Name: dimethyl 3-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]acetyl]amino]pentanedioate CAS Name: 3-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-1-oxoethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[[2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]acetyl]amino]pentanedioate Traditional Name: 3-[[2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]acetyl]amino]glutaric acid dimethyl ester Formula: C19H25N5O6 MolecularWeight: 419.4317

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)OC)NC(=O)CN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CC(CC(=O)OC)NC(=O)CN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H25N5O6/c1-29-16(26)9-13(10-17(27)30-2)22-15(25)11-23-7-8-24(19(23)28)14-5-3-12(4-6-14)18(20)21/h3-6,13H,7-11H2,1-2H3,(H3,20,21)(H,22,25)