1-[(3R)-3-(4-chlorophenyl)-6-methyl-heptyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(3R)-3-(4-chlorophenyl)-6-methyl-heptyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(3R)-3-(4-chlorophenyl)-6-methyl-heptyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(3R)-3-(4-chlorophenyl)-6-methylheptyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(3R)-3-(4-chlorophenyl)-6-methylheptyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[(3R)-3-(4-chlorophenyl)-6-methyl-heptyl]-4-methyl-piperazine-1,4-diium Formula: C19H33ClN2+2 MolecularWeight: 324.93172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31ClN2/c1-16(2)4-5-18(17-6-8-19(20)9-7-17)10-11-22-14-12-21(3)13-15-22/h6-9,16,18H,4-5,10-15H2,1-3H3/p+2/t18-/m1/s1