methyl 4-[3-(3-tert-butyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethyloxy)phenyl]benzoate

Systemtic Name: methyl 4-[3-(3-tert-butyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethyloxy)phenyl]benzoate Openeye Name: methyl 4-[3-(3-tert-butyl-4-pyrrolidin-1-yl-phenyl)-4-(2-hydroxyethoxy)phenyl]benzoate CAS Name: 4-[3-[3-tert-butyl-4-(1-pyrrolidinyl)phenyl]-4-(2-hydroxyethoxy)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3-tert-butyl-4-pyrrolidin-1-ylphenyl)-4-(2-hydroxyethoxy)phenyl]benzoate Traditional Name: 4-[3-(3-tert-butyl-4-pyrrolidino-phenyl)-4-(2-hydroxyethoxy)phenyl]benzoic acid methyl ester Formula: C30H35NO4 MolecularWeight: 473.6032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)OC)OCCO)N4CCCC4

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)OC)OCCO)N4CCCC4

InChI

InChI=1S/C30H35NO4/c1-30(2,3)26-20-24(11-13-27(26)31-15-5-6-16-31)25-19-23(12-14-28(25)35-18-17-32)21-7-9-22(10-8-21)29(33)34-4/h7-14,19-20,32H,5-6,15-18H2,1-4H3