2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]-3,3-dimethyl-butanoic acid Openeye Name: 2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]-3,3-dimethyl-butanoic acid CAS Name: 2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-3,3-dimethylbutanoic acid IUPAC Name: 2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]-3,3-dimethylbutanoic acid Traditional Name: 2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]-3,3-dimethyl-butyric acid Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)N1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C)(C)C(C(=O)O)N1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C16H22N4O3/c1-16(2,3)12(14(21)22)20-9-8-19(15(20)23)11-6-4-10(5-7-11)13(17)18/h4-7,12H,8-9H2,1-3H3,(H3,17,18)(H,21,22)