(4-tert-butylphenyl)methyl-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-[4-(2-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl]-methyl-ammonium Formula: C24H33FN3O+ MolecularWeight: 398.536723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C24H32FN3O/c1-24(2,3)20-11-9-19(10-12-20)17-26(4)18-23(29)28-15-13-27(14-16-28)22-8-6-5-7-21(22)25/h5-12H,13-18H2,1-4H3/p+1