[(1R,2R)-1-azanyl-1-phenyl-butan-2-yl]-dibutyl-azanium

Systemtic Name: [(1R,2R)-1-azanyl-1-phenyl-butan-2-yl]-dibutyl-azanium Openeye Name: [(1R)-1-[(R)-amino(phenyl)methyl]propyl]-dibutyl-ammonium CAS Name: [(1R,2R)-1-amino-1-phenylbutan-2-yl]-dibutylammonium IUPAC Name: [(1R,2R)-1-amino-1-phenylbutan-2-yl]-dibutylazanium Traditional Name: [(1R)-1-[(R)-amino(phenyl)methyl]propyl]-dibutyl-ammonium Formula: C18H33N2+ MolecularWeight: 277.46802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H32N2/c1-4-7-14-20(15-8-5-2)17(6-3)18(19)16-12-10-9-11-13-16/h9-13,17-18H,4-8,14-15,19H2,1-3H3/p+1/t17-,18-/m1/s1