(Z)-3-(dimethylamino)-2-(4-fluoranyl-2-methyl-phenyl)carbonyl-prop-2-enoic acid

Systemtic Name: (Z)-3-(dimethylamino)-2-(4-fluoranyl-2-methyl-phenyl)carbonyl-prop-2-enoic acid Openeye Name: (Z)-3-(dimethylamino)-2-(4-fluoro-2-methyl-benzoyl)prop-2-enoic acid CAS Name: (Z)-3-(dimethylamino)-2-[(4-fluoro-2-methylphenyl)-oxomethyl]-2-propenoic acid IUPAC Name: (Z)-3-(dimethylamino)-2-(4-fluoro-2-methylbenzoyl)prop-2-enoic acid Traditional Name: (Z)-3-(dimethylamino)-2-(4-fluoro-2-methyl-benzoyl)acrylic acid Formula: C13H14FNO3 MolecularWeight: 251.253563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C(=O)C(=CN(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)F)C(=O)/C(=C/N(C)C)/C(=O)O

InChI

InChI=1S/C13H14FNO3/c1-8-6-9(14)4-5-10(8)12(16)11(13(17)18)7-15(2)3/h4-7H,1-3H3,(H,17,18)/b11-7-