[(3S)-3-(4-methoxy-3-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(3S)-3-(4-methoxy-3-methylphenyl)-3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(3S)-3-(4-methoxy-3-methylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C16H29N3O+2 MolecularWeight: 279.42096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CC[NH3+])N2CC[NH+](CC2)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[C@H](CC[NH3+])N2CC[NH+](CC2)C)OC

InChI

InChI=1S/C16H27N3O/c1-13-12-14(4-5-16(13)20-3)15(6-7-17)19-10-8-18(2)9-11-19/h4-5,12,15H,6-11,17H2,1-3H3/p+2/t15-/m0/s1