3-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-(4-mesitylsulfonylpiperazino)-3-phenoxy-propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O4S/c1-17-15-18(2)22(19(3)16-17)29(26,27)24-12-10-23(11-13-24)21(25)9-14-28-20-7-5-4-6-8-20/h4-8,15-16H,9-14H2,1-3H3