4-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]-3-methyl-butanoic acid

Systemtic Name: 4-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]-3-methyl-butanoic acid Openeye Name: 4-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]phenyl]-3-methyl-butanoic acid CAS Name: 4-[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]phenyl]-3-methylbutanoic acid IUPAC Name: 4-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]phenyl]-3-methylbutanoic acid Traditional Name: 4-[4-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]phenyl]-3-methyl-butyric acid Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CC(=O)O

InChI

InChI=1S/C21H24N4O3/c1-14(13-19(26)27)12-15-2-6-17(7-3-15)24-10-11-25(21(24)28)18-8-4-16(5-9-18)20(22)23/h2-9,14H,10-13H2,1H3,(H3,22,23)(H,26,27)