(E)-6-[2-(3-hydroxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]hex-4-enoic acid

Systemtic Name: (E)-6-[2-(3-hydroxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (E)-6-[1-benzyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (E)-6-[2-(3-hydroxyphenyl)-1-(phenylmethyl)-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (E)-6-[1-benzyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (E)-6-[1-benzyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1CC=CCCC(=O)O)C2=CC(=CC=C2)O)CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO3/c25-21-12-7-11-20(16-21)23-19(10-5-2-6-13-22(26)27)14-15-24(23)17-18-8-3-1-4-9-18/h1-5,7-9,11-12,16,19,23,25H,6,10,13-15,17H2,(H,26,27)/b5-2+