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

Systemtic Name: (Z)-6-[2-phenyl-1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (Z)-6-[2-phenyl-1-(3-pyridylmethyl)pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (Z)-6-[2-phenyl-1-(3-pyridinylmethyl)-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (Z)-6-[2-phenyl-1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (Z)-6-[2-phenyl-1-(3-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=CN=CC=C3

Isomeric SMILES

C1CN(C(C1C/C=C\CCC(=O)O)C2=CC=CC=C2)CC3=CN=CC=C3

InChI

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