[(1S,2R)-1-azanyl-3-methyl-1-phenyl-butan-2-yl]-butyl-ethyl-azanium

Systemtic Name: [(1S,2R)-1-azanyl-3-methyl-1-phenyl-butan-2-yl]-butyl-ethyl-azanium Openeye Name: [(1R)-1-[(S)-amino(phenyl)methyl]-2-methyl-propyl]-butyl-ethyl-ammonium CAS Name: [(1S,2R)-1-amino-3-methyl-1-phenylbutan-2-yl]-butyl-ethylammonium IUPAC Name: [(1S,2R)-1-amino-3-methyl-1-phenylbutan-2-yl]-butyl-ethylazanium Traditional Name: [(1R)-1-[(S)-amino(phenyl)methyl]-2-methyl-propyl]-butyl-ethyl-ammonium Formula: C17H31N2+ MolecularWeight: 263.44144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2/c1-5-7-13-19(6-2)17(14(3)4)16(18)15-11-9-8-10-12-15/h8-12,14,16-17H,5-7,13,18H2,1-4H3/p+1/t16-,17+/m0/s1