4-[[(1Z)-1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(1Z)-1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(1Z)-1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxy-4-oxo-butanoic acid CAS Name: 4-[[(1Z)-1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)dodecyl]amino]oxy-4-oxobutanoic acid IUPAC Name: 4-[[(1Z)-1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxy-4-oxobutanoic acid Traditional Name: 4-keto-4-[[(1Z)-1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxy-butyric acid Formula: C23H35NO5 MolecularWeight: 405.5277

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=C1C=C(C=CC1=O)C)NOC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCC/C(=C/1\C=C(C=CC1=O)C)/NOC(=O)CCC(=O)O

InChI

InChI=1S/C23H35NO5/c1-3-4-5-6-7-8-9-10-11-12-20(19-17-18(2)13-14-21(19)25)24-29-23(28)16-15-22(26)27/h13-14,17,24H,3-12,15-16H2,1-2H3,(H,26,27)/b20-19-