9-[4-[bis(azanyl)methylidene]-2-oxidanyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]nonanoic acid

Systemtic Name: 9-[4-[bis(azanyl)methylidene]-2-oxidanyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]nonanoic acid Openeye Name: 9-[4-(diaminomethylene)-2-hydroxy-3-oxo-cyclohexa-1,5-dien-1-yl]nonanoic acid CAS Name: 9-[4-(diaminomethylidene)-2-hydroxy-3-oxo-1-cyclohexa-1,5-dienyl]nonanoic acid IUPAC Name: 9-[4-(diaminomethylidene)-2-hydroxy-3-oxocyclohexa-1,5-dien-1-yl]nonanoic acid Traditional Name: 9-[4-(diaminomethylene)-2-hydroxy-3-keto-cyclohexa-1,5-dien-1-yl]pelargonic acid Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N)N)C(=O)C(=C1CCCCCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(N)N)C(=O)C(=C1CCCCCCCCC(=O)O)O

InChI

InChI=1S/C16H24N2O4/c17-16(18)12-10-9-11(14(21)15(12)22)7-5-3-1-2-4-6-8-13(19)20/h9-10,21H,1-8,17-18H2,(H,19,20)