2-[[3-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-oxazol-5-yl]methylamino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-oxazol-5-yl]methylamino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[3-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)isoxazol-5-yl]methylamino]-2-oxo-acetic acid CAS Name: 2-[[3-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-5-isoxazolyl]methylamino]-2-oxoacetic acid IUPAC Name: 2-[[3-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-oxazol-5-yl]methylamino]-2-oxoacetic acid Traditional Name: 2-[[3-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-4-isoxazolin-5-yl]methylamino]-2-keto-acetic acid Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C=C(ON2)CNC(=O)C(=O)O)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C=C(ON2)CNC(=O)C(=O)O)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C20H26N2O5/c1-19(2,3)13-7-11(8-14(16(13)23)20(4,5)6)15-9-12(27-22-15)10-21-17(24)18(25)26/h7-9,22H,10H2,1-6H3,(H,21,24)(H,25,26)