2,6-dimethoxy-4-[(3-oxidanylpropylamino)methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-dimethoxy-4-[(3-oxidanylpropylamino)methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(3-hydroxypropylamino)methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[(3-hydroxypropylamino)methylidene]-2,6-dimethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(3-hydroxypropylamino)methylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[(3-hydroxypropylamino)methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNCCCO)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=CNCCCO)C=C(C1=O)OC

InChI

InChI=1S/C12H17NO4/c1-16-10-6-9(8-13-4-3-5-14)7-11(17-2)12(10)15/h6-8,13-14H,3-5H2,1-2H3