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

Systemtic Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium Openeye Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-(2-phenoxyethyl)ammonium CAS Name: methyl-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-(2-phenoxyethyl)ammonium IUPAC Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-(2-phenoxyethyl)azanium Traditional Name: [2-keto-2-(4-mesylpiperazino)ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C16H26N3O4S+ MolecularWeight: 356.46034

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H25N3O4S/c1-17(12-13-23-15-6-4-3-5-7-15)14-16(20)18-8-10-19(11-9-18)24(2,21)22/h3-7H,8-14H2,1-2H3/p+1