3-[4-[[4-[(3-phenethylpyrrolidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-[(3-phenethylpyrrolidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid Openeye Name: 3-[4-[[4-[(3-phenethylpyrrolidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid CAS Name: 3-[4-[[4-[(3-phenethyl-1-pyrrolidinyl)methyl]phenyl]methoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-[(3-phenethylpyrrolidin-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid Traditional Name: 3-[4-[4-[(3-phenethylpyrrolidino)methyl]benzyl]oxyphenyl]propionic acid Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CCC2=CC=CC=C2)CC3=CC=C(C=C3)COC4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

C1CN(CC1CCC2=CC=CC=C2)CC3=CC=C(C=C3)COC4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C29H33NO3/c31-29(32)17-14-24-12-15-28(16-13-24)33-22-27-10-8-25(9-11-27)20-30-19-18-26(21-30)7-6-23-4-2-1-3-5-23/h1-5,8-13,15-16,26H,6-7,14,17-22H2,(H,31,32)