[(1R,2R)-1-azanyl-1-(4-methylphenyl)propan-2-yl]-dipropyl-azanium

Systemtic Name: [(1R,2R)-1-azanyl-1-(4-methylphenyl)propan-2-yl]-dipropyl-azanium Openeye Name: [(1R,2R)-2-amino-1-methyl-2-(p-tolyl)ethyl]-dipropyl-ammonium CAS Name: [(1R,2R)-1-amino-1-(4-methylphenyl)propan-2-yl]-dipropylammonium IUPAC Name: [(1R,2R)-1-amino-1-(4-methylphenyl)propan-2-yl]-dipropylazanium Traditional Name: [(1R,2R)-2-amino-1-methyl-2-(p-tolyl)ethyl]-dipropyl-ammonium Formula: C16H29N2+ MolecularWeight: 249.41486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-5-11-18(12-6-2)14(4)16(17)15-9-7-13(3)8-10-15/h7-10,14,16H,5-6,11-12,17H2,1-4H3/p+1/t14-,16+/m1/s1