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

Systemtic Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)-2-methyl-propyl]piperazin-4-ium Openeye Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)-2-methyl-propyl]piperazin-4-ium CAS Name: 1-[(1S)-1-(2-methoxy-5-methylphenyl)-2-methylpropyl]piperazin-4-ium IUPAC Name: 1-[(1S)-1-(2-methoxy-5-methylphenyl)-2-methylpropyl]piperazin-4-ium Traditional Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)-2-methyl-propyl]piperazin-4-ium Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O/c1-12(2)16(18-9-7-17-8-10-18)14-11-13(3)5-6-15(14)19-4/h5-6,11-12,16-17H,7-10H2,1-4H3/p+1/t16-/m0/s1