[(3R)-3-(4-tert-butylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(3R)-3-(4-tert-butylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(3R)-3-(4-tert-butylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(3R)-3-(4-tert-butylphenyl)-3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(3R)-3-(4-tert-butylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(3R)-3-(4-tert-butylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C18H33N3+2 MolecularWeight: 291.47472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CC[NH3+])N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@@H](CC[NH3+])N2CC[NH+](CC2)C

InChI

InChI=1S/C18H31N3/c1-18(2,3)16-7-5-15(6-8-16)17(9-10-19)21-13-11-20(4)12-14-21/h5-8,17H,9-14,19H2,1-4H3/p+2/t17-/m1/s1