[(S)-benzotriazol-1-yl(phenyl)methyl]-butyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-butyl-[(4-fluorophenyl)methyl]azanium Openeye Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-butyl-[(4-fluorophenyl)methyl]ammonium CAS Name: [(S)-1-benzotriazolyl(phenyl)methyl]-butyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-butyl-[(4-fluorophenyl)methyl]azanium Traditional Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-butyl-(4-fluorobenzyl)ammonium Formula: C24H26FN4+ MolecularWeight: 389.488443

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=C(C=C1)F)C(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCC[NH+](CC1=CC=C(C=C1)F)[C@H](C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C24H25FN4/c1-2-3-17-28(18-19-13-15-21(25)16-14-19)24(20-9-5-4-6-10-20)29-23-12-8-7-11-22(23)26-27-29/h4-16,24H,2-3,17-18H2,1H3/p+1/t24-/m0/s1