[(1S,2R)-1-azanyl-1-phenyl-butan-2-yl]-butyl-methyl-azanium

Systemtic Name: [(1S,2R)-1-azanyl-1-phenyl-butan-2-yl]-butyl-methyl-azanium Openeye Name: [(1R)-1-[(S)-amino(phenyl)methyl]propyl]-butyl-methyl-ammonium CAS Name: [(1S,2R)-1-amino-1-phenylbutan-2-yl]-butyl-methylammonium IUPAC Name: [(1S,2R)-1-amino-1-phenylbutan-2-yl]-butyl-methylazanium Traditional Name: [(1R)-1-[(S)-amino(phenyl)methyl]propyl]-butyl-methyl-ammonium Formula: C15H27N2+ MolecularWeight: 235.38828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(CC)C(C1=CC=CC=C1)N

Isomeric SMILES

CCCC[NH+](C)[C@H](CC)[C@H](C1=CC=CC=C1)N

InChI

InChI=1S/C15H26N2/c1-4-6-12-17(3)14(5-2)15(16)13-10-8-7-9-11-13/h7-11,14-15H,4-6,12,16H2,1-3H3/p+1/t14-,15+/m1/s1