4-phenoxy-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-phenoxy-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-4-phenoxy-butan-1-one CAS Name: 4-phenoxy-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-4-phenoxybutan-1-one Traditional Name: 1-(4-benzylsulfonylpiperazino)-4-phenoxy-butan-1-one Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCOC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCCOC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c24-21(12-7-17-27-20-10-5-2-6-11-20)22-13-15-23(16-14-22)28(25,26)18-19-8-3-1-4-9-19/h1-6,8-11H,7,12-18H2