[(4S)-4-(3-methoxyphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CCC[NH3+])C2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H](CCC[NH3+])C2=CC(=CC=C2)OC

InChI

InChI=1S/C16H27N3O/c1-18-9-11-19(12-10-18)16(7-4-8-17)14-5-3-6-15(13-14)20-2/h3,5-6,13,16H,4,7-12,17H2,1-2H3/p+2/t16-/m0/s1