(E)-3-(dimethylamino)-1-(3-methylimidazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(dimethylamino)-1-(3-methylimidazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(dimethylamino)-1-(3-methylimidazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(dimethylamino)-1-(3-methyl-4-imidazolyl)-2-propen-1-one IUPAC Name: (E)-3-(dimethylamino)-1-(3-methylimidazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(dimethylamino)-1-(3-methylimidazol-4-yl)prop-2-en-1-one Formula: C9H13N3O MolecularWeight: 179.21902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(=O)C=CN(C)C

Isomeric SMILES

CN1C=NC=C1C(=O)/C=C/N(C)C

InChI

InChI=1S/C9H13N3O/c1-11(2)5-4-9(13)8-6-10-7-12(8)3/h4-7H,1-3H3/b5-4+