1-[4-[[2-(aminomethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[[2-(aminomethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[[2-(aminomethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[2-(aminomethyl)phenyl]methylsulfonyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[[2-(aminomethyl)phenyl]methylsulfonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-(aminomethyl)benzyl]sulfonylpiperazino]ethanone Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2CN

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2CN

InChI

InChI=1S/C14H21N3O3S/c1-12(18)16-6-8-17(9-7-16)21(19,20)11-14-5-3-2-4-13(14)10-15/h2-5H,6-11,15H2,1H3