[(2S)-octan-2-yl]-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: [(2S)-octan-2-yl]-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: [(1S)-1-methylheptyl]-[(1R)-1-methyl-3-phenyl-propyl]ammonium CAS Name: [(2S)-octan-2-yl]-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: [(2S)-octan-2-yl]-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: [(1S)-1-methylheptyl]-[(1R)-1-methyl-3-phenyl-propyl]ammonium Formula: C18H32N+ MolecularWeight: 262.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]C(C)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCC[C@H](C)[NH2+][C@H](C)CCC1=CC=CC=C1

InChI

InChI=1S/C18H31N/c1-4-5-6-8-11-16(2)19-17(3)14-15-18-12-9-7-10-13-18/h7,9-10,12-13,16-17,19H,4-6,8,11,14-15H2,1-3H3/p+1/t16-,17+/m0/s1