6-[1-(oxidanylamino)ethylidene]-3-[(2R)-2-oxidanylbutoxy]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[1-(oxidanylamino)ethylidene]-3-[(2R)-2-oxidanylbutoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[1-(hydroxyamino)ethylidene]-3-[(2R)-2-hydroxybutoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[1-(hydroxyamino)ethylidene]-3-[(2R)-2-hydroxybutoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[1-(hydroxyamino)ethylidene]-3-[(2R)-2-hydroxybutoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[1-(hydroxyamino)ethylidene]-3-[(2R)-2-hydroxybutoxy]cyclohexa-2,4-dien-1-one Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC(=O)C(=C(C)NO)C=C1)O

Isomeric SMILES

CC[C@H](COC1=CC(=O)C(=C(C)NO)C=C1)O

InChI

InChI=1S/C12H17NO4/c1-3-9(14)7-17-10-4-5-11(8(2)13-16)12(15)6-10/h4-6,9,13-14,16H,3,7H2,1-2H3/t9-/m1/s1