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

Systemtic Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)propyl]piperazin-4-ium Openeye Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)propyl]piperazin-4-ium CAS Name: 1-[(1S)-1-(2-methoxy-5-methylphenyl)propyl]piperazin-4-ium IUPAC Name: 1-[(1S)-1-(2-methoxy-5-methylphenyl)propyl]piperazin-4-ium Traditional Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)propyl]piperazin-4-ium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O/c1-4-14(17-9-7-16-8-10-17)13-11-12(2)5-6-15(13)18-3/h5-6,11,14,16H,4,7-10H2,1-3H3/p+1/t14-/m0/s1