3-piperidin-1-ium-1-ylpropyl-[(1S)-1-(4-propan-2-ylphenyl)ethyl]azanium

Systemtic Name: 3-piperidin-1-ium-1-ylpropyl-[(1S)-1-(4-propan-2-ylphenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-isopropylphenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: 3-(1-piperidin-1-iumyl)propyl-[(1S)-1-(4-propan-2-ylphenyl)ethyl]ammonium IUPAC Name: 3-piperidin-1-ium-1-ylpropyl-[(1S)-1-(4-propan-2-ylphenyl)ethyl]azanium Traditional Name: [(1S)-1-p-cumenylethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C19H34N2+2 MolecularWeight: 290.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)C(C)C)[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C19H32N2/c1-16(2)18-8-10-19(11-9-18)17(3)20-12-7-15-21-13-5-4-6-14-21/h8-11,16-17,20H,4-7,12-15H2,1-3H3/p+2/t17-/m0/s1