[(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: [(2S)-2-methylpentyl]-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2/c1-3-9-16(2)14-19-15-18(20-12-7-8-13-20)17-10-5-4-6-11-17/h4-6,10-11,16,18-19H,3,7-9,12-15H2,1-2H3/p+2/t16-,18-/m0/s1