3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptyl-carbamic acid

Systemtic Name: 3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptyl-carbamic acid Openeye Name: 3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptyl-carbamic acid CAS Name: 3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptylcarbamic acid IUPAC Name: 3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptylcarbamic acid Traditional Name: 3,3-bis(4-fluorophenyl)prop-1-ynyl-cycloheptyl-carbamic acid Formula: C23H23F2NO2 MolecularWeight: 383.431026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N(C#CC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

C1CCCC(CC1)N(C#CC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C23H23F2NO2/c24-19-11-7-17(8-12-19)22(18-9-13-20(25)14-10-18)15-16-26(23(27)28)21-5-3-1-2-4-6-21/h7-14,21-22H,1-6H2,(H,27,28)