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1-(3,5-dimethylpiperidin-1-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone

1-(3,5-dimethylpiperidin-1-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone

Systemtic Name:1-(3,5-dimethylpiperidin-1-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone
Openeye Name:1-(3,5-dimethyl-1-piperidyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone
CAS Name:1-(3,5-dimethyl-1-piperidinyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]ethanone
IUPAC Name:1-(3,5-dimethylpiperidin-1-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)ethanone
Traditional Name:1-(3,5-dimethylpiperidino)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)ethanone
Formula: C19H27N3O6S
MolecularWeight: 425.49918
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C


Isomeric SMILES

CC1CC(CN(C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C


InChI

InChI=1S/C19H27N3O6S/c1-14-9-15(2)12-20(11-14)19(23)13-28-18-6-5-16(10-17(18)22(24)25)29(26,27)21-7-3-4-8-21/h5-6,10,14-15H,3-4,7-9,11-13H2,1-2H3


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