3-[3-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]phenyl]propanoic acid

Systemtic Name: 3-[3-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-yl-prop-1-enyl]phenyl]propanoic acid Openeye Name: 3-[3-[(E)-1-(p-tolyl)-3-pyrrolidin-1-yl-prop-1-enyl]phenyl]propanoic acid CAS Name: 3-[3-[(E)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)prop-1-enyl]phenyl]propanoic acid IUPAC Name: 3-[3-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]phenyl]propanoic acid Traditional Name: 3-[3-[(E)-1-(p-tolyl)-3-pyrrolidino-prop-1-enyl]phenyl]propionic acid Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CCN2CCCC2)C3=CC(=CC=C3)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC(=CC=C3)CCC(=O)O

InChI

InChI=1S/C23H27NO2/c1-18-7-10-20(11-8-18)22(13-16-24-14-2-3-15-24)21-6-4-5-19(17-21)9-12-23(25)26/h4-8,10-11,13,17H,2-3,9,12,14-16H2,1H3,(H,25,26)/b22-13+