[1-(4-fluorophenyl)-4-pyrrolidin-1-yl-butyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [1-(4-fluorophenyl)-4-pyrrolidin-1-yl-butyl] 3,4,5-trimethoxybenzoate Openeye Name: [1-(4-fluorophenyl)-4-pyrrolidin-1-yl-butyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [1-(4-fluorophenyl)-4-(1-pyrrolidinyl)butyl] ester IUPAC Name: [1-(4-fluorophenyl)-4-pyrrolidin-1-ylbutyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [1-(4-fluorophenyl)-4-pyrrolidino-butyl] ester Formula: C24H30FNO5 MolecularWeight: 431.497103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC(CCCN2CCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC(CCCN2CCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H30FNO5/c1-28-21-15-18(16-22(29-2)23(21)30-3)24(27)31-20(17-8-10-19(25)11-9-17)7-6-14-26-12-4-5-13-26/h8-11,15-16,20H,4-7,12-14H2,1-3H3