3-phenoxy-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-phenoxy-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-phenoxy-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-phenoxy-1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-phenoxy-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-phenoxy-1-[4-(4-propylphenyl)sulfonylpiperazino]propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-2-6-19-9-11-21(12-10-19)29(26,27)24-16-14-23(15-17-24)22(25)13-18-28-20-7-4-3-5-8-20/h3-5,7-12H,2,6,13-18H2,1H3