4-[[[(E)-(3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[[(E)-(3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[(E)-(3-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(E)-(3-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[(E)-(3-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[(E)-(3-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]methyl]cyclohexanecarboxylic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC=C2C=C(C=CC2=O)O)C(=O)O

Isomeric SMILES

C1CC(CCC1CN/C=C/2\C=C(C=CC2=O)O)C(=O)O

InChI

InChI=1S/C15H19NO4/c17-13-5-6-14(18)12(7-13)9-16-8-10-1-3-11(4-2-10)15(19)20/h5-7,9-11,16-17H,1-4,8H2,(H,19,20)/b12-9+