methyl-[(2S)-3-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: methyl-[(2S)-3-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-[4-(m-tolyl)piperazin-1-yl]propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-[4-(m-tolyl)piperazino]propyl]-methyl-ammonium Formula: C15H26N3O+ MolecularWeight: 264.38644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(C[NH2+]C)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C[C@H](C[NH2+]C)O

InChI

InChI=1S/C15H25N3O/c1-13-4-3-5-14(10-13)18-8-6-17(7-9-18)12-15(19)11-16-2/h3-5,10,15-16,19H,6-9,11-12H2,1-2H3/p+1/t15-/m0/s1