4-[3-(3,5-diethyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethyloxy)phenyl]benzoic acid

Systemtic Name: 4-[3-(3,5-diethyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethyloxy)phenyl]benzoic acid Openeye Name: 4-[3-(3,5-diethyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethoxy)phenyl]benzoic acid CAS Name: 4-[3-[3,5-diethyl-4-(1-pyrrolidinyl)phenyl]-4-(2-hydroxyethoxy)phenyl]benzoic acid IUPAC Name: 4-[3-(3,5-diethyl-4-pyrrolidin-1-ylphenyl)-4-(2-hydroxyethoxy)phenyl]benzoic acid Traditional Name: 4-[3-(3,5-diethyl-4-pyrrolidino-phenyl)-4-(2-hydroxyethoxy)phenyl]benzoic acid Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1N2CCCC2)CC)C3=C(C=CC(=C3)C4=CC=C(C=C4)C(=O)O)OCCO

Isomeric SMILES

CCC1=CC(=CC(=C1N2CCCC2)CC)C3=C(C=CC(=C3)C4=CC=C(C=C4)C(=O)O)OCCO

InChI

InChI=1S/C29H33NO4/c1-3-20-17-25(18-21(4-2)28(20)30-13-5-6-14-30)26-19-24(11-12-27(26)34-16-15-31)22-7-9-23(10-8-22)29(32)33/h7-12,17-19,31H,3-6,13-16H2,1-2H3,(H,32,33)