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

Systemtic Name: (E)-6-[2-(3-methoxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (E)-6-[1-benzyl-2-(3-methoxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (E)-6-[2-(3-methoxyphenyl)-1-(phenylmethyl)-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (E)-6-[1-benzyl-2-(3-methoxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (E)-6-[1-benzyl-2-(3-methoxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(CCN2CC3=CC=CC=C3)CC=CCCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2C(CCN2CC3=CC=CC=C3)C/C=C/CCC(=O)O

InChI

InChI=1S/C24H29NO3/c1-28-22-13-8-12-21(17-22)24-20(11-6-3-7-14-23(26)27)15-16-25(24)18-19-9-4-2-5-10-19/h2-6,8-10,12-13,17,20,24H,7,11,14-16,18H2,1H3,(H,26,27)/b6-3+