(2S)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-butan-1-one

Systemtic Name: (2S)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-butan-1-one Openeye Name: (2S)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methyl-butan-1-one CAS Name: (2S)-1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-methyl-1-butanone IUPAC Name: (2S)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-methylbutan-1-one Traditional Name: (2S)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-methyl-butan-1-one Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC[C@H](C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H26N2O5S/c1-5-13(2)17(20)18-8-10-19(11-9-18)25(21,22)14-6-7-15(23-3)16(12-14)24-4/h6-7,12-13H,5,8-11H2,1-4H3/t13-/m0/s1