4-[[3-(4-carbamimidoylphenyl)-6-oxidanylidene-1H-pyridazin-5-yl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[3-(4-carbamimidoylphenyl)-6-oxidanylidene-1H-pyridazin-5-yl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[3-(4-carbamimidoylphenyl)-6-oxo-1H-pyridazine-5-carbonyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[[3-(4-carbamimidoylphenyl)-6-oxo-1H-pyridazin-5-yl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[3-(4-carbamimidoylphenyl)-6-oxo-1H-pyridazine-5-carbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[3-(4-amidinophenyl)-6-keto-1H-pyridazine-5-carbonyl]amino]cyclohexanecarboxylic acid Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC(=O)C2=CC(=NNC2=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CC(CCC1C(=O)O)NC(=O)C2=CC(=NNC2=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H21N5O4/c20-16(21)11-3-1-10(2-4-11)15-9-14(18(26)24-23-15)17(25)22-13-7-5-12(6-8-13)19(27)28/h1-4,9,12-13H,5-8H2,(H3,20,21)(H,22,25)(H,24,26)(H,27,28)