[(1S)-1-(3-chlorophenyl)propyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(3-chlorophenyl)propyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(3-chlorophenyl)propyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(3-chlorophenyl)propyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(3-chlorophenyl)propyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-(3-chlorophenyl)propyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C16H27ClN2+2 MolecularWeight: 282.85198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2/c1-2-16(14-7-5-8-15(17)13-14)18-9-6-12-19-10-3-4-11-19/h5,7-8,13,16,18H,2-4,6,9-12H2,1H3/p+2/t16-/m0/s1