(E)-3-[4-(dimethylamino)-3-methyl-phenyl]but-2-enoic acid

Systemtic Name: (E)-3-[4-(dimethylamino)-3-methyl-phenyl]but-2-enoic acid Openeye Name: (E)-3-[4-(dimethylamino)-3-methyl-phenyl]but-2-enoic acid CAS Name: (E)-3-[4-(dimethylamino)-3-methylphenyl]-2-butenoic acid IUPAC Name: (E)-3-[4-(dimethylamino)-3-methylphenyl]but-2-enoic acid Traditional Name: (E)-3-[4-(dimethylamino)-3-methyl-phenyl]but-2-enoic acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO2/c1-9(8-13(15)16)11-5-6-12(14(3)4)10(2)7-11/h5-8H,1-4H3,(H,15,16)/b9-8+