3-chloranyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-chloranyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-chloro-propan-1-one CAS Name: 3-chloro-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-chloropropan-1-one Traditional Name: 1-(4-benzylsulfonylpiperazino)-3-chloro-propan-1-one Formula: C14H19ClN2O3S MolecularWeight: 330.83026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCl)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CCCl)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H19ClN2O3S/c15-7-6-14(18)16-8-10-17(11-9-16)21(19,20)12-13-4-2-1-3-5-13/h1-5H,6-12H2