3-[(5-butyl-2-methoxy-phenyl)methylamino]-2-(4-fluorophenyl)cyclopentane-1-carboxylic acid

Systemtic Name: 3-[(5-butyl-2-methoxy-phenyl)methylamino]-2-(4-fluorophenyl)cyclopentane-1-carboxylic acid Openeye Name: 3-[(5-butyl-2-methoxy-phenyl)methylamino]-2-(4-fluorophenyl)cyclopentanecarboxylic acid CAS Name: 3-[(5-butyl-2-methoxyphenyl)methylamino]-2-(4-fluorophenyl)-1-cyclopentanecarboxylic acid IUPAC Name: 3-[(5-butyl-2-methoxyphenyl)methylamino]-2-(4-fluorophenyl)cyclopentane-1-carboxylic acid Traditional Name: 3-[(5-butyl-2-methoxy-benzyl)amino]-2-(4-fluorophenyl)cyclopentanecarboxylic acid Formula: C24H30FNO3 MolecularWeight: 399.498303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OC)CNC2CCC(C2C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OC)CNC2CCC(C2C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C24H30FNO3/c1-3-4-5-16-6-13-22(29-2)18(14-16)15-26-21-12-11-20(24(27)28)23(21)17-7-9-19(25)10-8-17/h6-10,13-14,20-21,23,26H,3-5,11-12,15H2,1-2H3,(H,27,28)