[(2S)-4-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium

Systemtic Name: [(2S)-4-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium Openeye Name: [(1S)-3-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-propyl]ammonium CAS Name: [(2S)-4-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]butan-2-yl]ammonium IUPAC Name: [(2S)-4-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]butan-2-yl]azanium Traditional Name: [(1S)-3-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-propyl]ammonium Formula: C15H27N3O+2 MolecularWeight: 265.39438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O/c1-13(16)6-7-17-8-10-18(11-9-17)14-4-3-5-15(12-14)19-2/h3-5,12-13H,6-11,16H2,1-2H3/p+2/t13-/m0/s1