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

Systemtic Name: 2-[[(1Z)-1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxyethanoic acid Openeye Name: 2-[[(1Z)-1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxyacetic acid CAS Name: 2-[[(1Z)-1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)dodecyl]amino]oxyacetic acid IUPAC Name: 2-[[(1Z)-1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxyacetic acid Traditional Name: 2-[[(1Z)-1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)dodecyl]amino]oxyacetic acid Formula: C21H33NO4 MolecularWeight: 363.49102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=C1C=C(C=CC1=O)C)NOCC(=O)O

Isomeric SMILES

CCCCCCCCCCC/C(=C/1\C=C(C=CC1=O)C)/NOCC(=O)O

InChI

InChI=1S/C21H33NO4/c1-3-4-5-6-7-8-9-10-11-12-19(22-26-16-21(24)25)18-15-17(2)13-14-20(18)23/h13-15,22H,3-12,16H2,1-2H3,(H,24,25)/b19-18-