2-[3-(4-chlorophenyl)propyl]-1-heptyl-1-azoniabicyclo[2.2.2]octan-3-one

Systemtic Name: 2-[3-(4-chlorophenyl)propyl]-1-heptyl-1-azoniabicyclo[2.2.2]octan-3-one Openeye Name: 2-[3-(4-chlorophenyl)propyl]-1-heptyl-quinuclidin-1-ium-3-one CAS Name: 2-[3-(4-chlorophenyl)propyl]-1-heptyl-1-azoniabicyclo[2.2.2]octan-3-one IUPAC Name: 2-[3-(4-chlorophenyl)propyl]-1-heptyl-1-azoniabicyclo[2.2.2]octan-3-one Traditional Name: 2-[3-(4-chlorophenyl)propyl]-1-heptyl-quinuclidin-1-ium-3-one Formula: C23H35ClNO+ MolecularWeight: 376.9831

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]12CCC(CC1)C(=O)C2CCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCC[N+]12CCC(CC1)C(=O)C2CCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H35ClNO/c1-2-3-4-5-6-16-25-17-14-20(15-18-25)23(26)22(25)9-7-8-19-10-12-21(24)13-11-19/h10-13,20,22H,2-9,14-18H2,1H3/q+1