[(2R)-2-[4-(3-methylphenyl)piperazin-1-yl]heptyl]azanium

Systemtic Name: [(2R)-2-[4-(3-methylphenyl)piperazin-1-yl]heptyl]azanium Openeye Name: [(2R)-2-[4-(m-tolyl)piperazin-1-yl]heptyl]ammonium CAS Name: [(2R)-2-[4-(3-methylphenyl)-1-piperazinyl]heptyl]ammonium IUPAC Name: [(2R)-2-[4-(3-methylphenyl)piperazin-1-yl]heptyl]azanium Traditional Name: [(2R)-2-[4-(m-tolyl)piperazino]heptyl]ammonium Formula: C18H32N3+ MolecularWeight: 290.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C[NH3+])N1CCN(CC1)C2=CC=CC(=C2)C

Isomeric SMILES

CCCCC[C@H](C[NH3+])N1CCN(CC1)C2=CC=CC(=C2)C

InChI

InChI=1S/C18H31N3/c1-3-4-5-8-18(15-19)21-12-10-20(11-13-21)17-9-6-7-16(2)14-17/h6-7,9,14,18H,3-5,8,10-13,15,19H2,1-2H3/p+1/t18-/m1/s1