(E)-3-[4-(3,5-dimethylpiperidin-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(3,5-dimethylpiperidin-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(3,5-dimethyl-1-piperidyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(3,5-dimethyl-1-piperidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(3,5-dimethylpiperidin-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(3,5-dimethylpiperidino)phenyl]acrylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=CC=C(C=C2)C=CC(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)C2=CC=C(C=C2)/C=C/C(=O)O)C

InChI

InChI=1S/C16H21NO2/c1-12-9-13(2)11-17(10-12)15-6-3-14(4-7-15)5-8-16(18)19/h3-8,12-13H,9-11H2,1-2H3,(H,18,19)/b8-5+