methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[(1S)-1-phenylethyl]azanium

Systemtic Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[(1S)-1-phenylethyl]azanium Openeye Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-[(1S)-1-phenylethyl]ammonium CAS Name: methyl-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-[(1S)-1-phenylethyl]ammonium IUPAC Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-[(1S)-1-phenylethyl]azanium Traditional Name: [2-keto-2-(4-mesylpiperazino)ethyl]-methyl-[(1S)-1-phenylethyl]ammonium Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+](C)CC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+](C)CC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H25N3O3S/c1-14(15-7-5-4-6-8-15)17(2)13-16(20)18-9-11-19(12-10-18)23(3,21)22/h4-8,14H,9-13H2,1-3H3/p+1/t14-/m0/s1