4-[(2S)-3-(4-ethanoyl-2-methoxy-phenoxy)-2-oxidanyl-propyl]-N,N-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[(2S)-3-(4-ethanoyl-2-methoxy-phenoxy)-2-oxidanyl-propyl]-N,N-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[(2S)-3-(4-acetyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[(2S)-3-(4-acetyl-2-methoxyphenoxy)-2-hydroxypropyl]-N,N-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[(2S)-3-(4-acetyl-2-methoxyphenoxy)-2-hydroxypropyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[(2S)-3-(4-acetyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C18H29N3O6S MolecularWeight: 415.50436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)N(C)C)O)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC[C@H](CN2CCN(CC2)S(=O)(=O)N(C)C)O)OC

InChI

InChI=1S/C18H29N3O6S/c1-14(22)15-5-6-17(18(11-15)26-4)27-13-16(23)12-20-7-9-21(10-8-20)28(24,25)19(2)3/h5-6,11,16,23H,7-10,12-13H2,1-4H3/t16-/m0/s1