[(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: [(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: [(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: [(1S)-1-(2,5-dimethylphenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]C(C)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+][C@@H](C)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C18H30N2/c1-5-10-20-11-8-17(9-12-20)19-16(4)18-13-14(2)6-7-15(18)3/h6-7,13,16-17,19H,5,8-12H2,1-4H3/p+2/t16-/m0/s1