1-[(2S)-5-(2-methoxy-5-methyl-phenyl)-5-methyl-hexan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2S)-5-(2-methoxy-5-methyl-phenyl)-5-methyl-hexan-2-yl]piperazin-4-ium Openeye Name: 1-[(1S)-4-(2-methoxy-5-methyl-phenyl)-1,4-dimethyl-pentyl]piperazin-4-ium CAS Name: 1-[(2S)-5-(2-methoxy-5-methylphenyl)-5-methylhexan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2S)-5-(2-methoxy-5-methylphenyl)-5-methylhexan-2-yl]piperazin-4-ium Traditional Name: 1-[(1S)-4-(2-methoxy-5-methyl-phenyl)-1,4-dimethyl-pentyl]piperazin-4-ium Formula: C19H33N2O+ MolecularWeight: 305.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)(C)CCC(C)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C)(C)CC[C@H](C)N2CC[NH2+]CC2

InChI

InChI=1S/C19H32N2O/c1-15-6-7-18(22-5)17(14-15)19(3,4)9-8-16(2)21-12-10-20-11-13-21/h6-7,14,16,20H,8-13H2,1-5H3/p+1/t16-/m0/s1