[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(4-ethoxy-3-methoxy-phenyl)methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(4-ethoxy-3-methoxy-phenyl)methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(4-ethoxy-3-methoxy-phenyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(4-ethoxy-3-methoxyphenyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(4-ethoxy-3-methoxyphenyl)methanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(4-ethoxy-3-methoxy-phenyl)methanone Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)OC

InChI

InChI=1S/C22H28N2O5S/c1-5-29-20-9-7-18(15-21(20)28-4)22(25)23-10-12-24(13-11-23)30(26,27)19-8-6-16(2)17(3)14-19/h6-9,14-15H,5,10-13H2,1-4H3