(E)-6-[2-phenyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]hex-4-enoic acid

Systemtic Name: (E)-6-[2-phenyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (E)-6-[2-phenyl-1-(2-pyridylmethyl)pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (E)-6-[2-phenyl-1-(2-pyridinylmethyl)-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (E)-6-[2-phenyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (E)-6-[2-phenyl-1-(2-pyridylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1CC=CCCC(=O)O)C2=CC=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

C1CN(C(C1C/C=C/CCC(=O)O)C2=CC=CC=C2)CC3=CC=CC=N3

InChI

InChI=1S/C22H26N2O2/c25-21(26)13-6-2-5-11-19-14-16-24(17-20-12-7-8-15-23-20)22(19)18-9-3-1-4-10-18/h1-5,7-10,12,15,19,22H,6,11,13-14,16-17H2,(H,25,26)/b5-2+