2-(3-methylphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-(3-methylphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(3-methylphenoxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 2-(3-methylphenoxy)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-(3-methylphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(3-methylphenoxy)-1-(4-tosylpiperazino)propan-1-one Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC=CC(=C3)C

InChI

InChI=1S/C21H26N2O4S/c1-16-7-9-20(10-8-16)28(25,26)23-13-11-22(12-14-23)21(24)18(3)27-19-6-4-5-17(2)15-19/h4-10,15,18H,11-14H2,1-3H3