[(1R,2R)-1-(4-butylphenyl)-2-phenyl-butyl]azanium

Systemtic Name: [(1R,2R)-1-(4-butylphenyl)-2-phenyl-butyl]azanium Openeye Name: [(1R,2R)-1-(4-butylphenyl)-2-phenyl-butyl]ammonium CAS Name: [(1R,2R)-1-(4-butylphenyl)-2-phenylbutyl]ammonium IUPAC Name: [(1R,2R)-1-(4-butylphenyl)-2-phenylbutyl]azanium Traditional Name: [(1R,2R)-1-(4-butylphenyl)-2-phenyl-butyl]ammonium Formula: C20H28N+ MolecularWeight: 282.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C(CC)C2=CC=CC=C2)[NH3+]

Isomeric SMILES

CCCCC1=CC=C(C=C1)[C@@H]([C@H](CC)C2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C20H27N/c1-3-5-9-16-12-14-18(15-13-16)20(21)19(4-2)17-10-7-6-8-11-17/h6-8,10-15,19-20H,3-5,9,21H2,1-2H3/p+1/t19-,20+/m1/s1