[(1S)-3-methyl-1-phenyl-butyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-3-methyl-1-phenyl-butyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-3-methyl-1-phenyl-butyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-3-methyl-1-phenylbutyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-3-methyl-1-phenylbutyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-3-methyl-1-phenyl-butyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)[NH2+]CCC[NH+]2CCCC2

Isomeric SMILES

CC(C)C[C@@H](C1=CC=CC=C1)[NH2+]CCC[NH+]2CCCC2

InChI

InChI=1S/C18H30N2/c1-16(2)15-18(17-9-4-3-5-10-17)19-11-8-14-20-12-6-7-13-20/h3-5,9-10,16,18-19H,6-8,11-15H2,1-2H3/p+2/t18-/m0/s1