3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S)-1-phenylpropyl]azanium

Systemtic Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S)-1-phenylpropyl]azanium Openeye Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S)-1-phenylpropyl]ammonium CAS Name: 3-(4-methyl-1-piperidin-1-iumyl)propyl-[(1S)-1-phenylpropyl]ammonium IUPAC Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S)-1-phenylpropyl]azanium Traditional Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S)-1-phenylpropyl]ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)[NH2+]CCC[NH+]2CCC(CC2)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)[NH2+]CCC[NH+]2CCC(CC2)C

InChI

InChI=1S/C18H30N2/c1-3-18(17-8-5-4-6-9-17)19-12-7-13-20-14-10-16(2)11-15-20/h4-6,8-9,16,18-19H,3,7,10-15H2,1-2H3/p+2/t18-/m0/s1