2-methyl-5-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-methyl-5-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]-1,3,4-oxadiazole Openeye Name: 2-methyl-5-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]-1,3,4-oxadiazole CAS Name: 2-methyl-5-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]methyl]-1,3,4-oxadiazole IUPAC Name: 2-methyl-5-[(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)methyl]-1,3,4-oxadiazole Traditional Name: 2-methyl-5-[(2-nitro-4-pyrrolidinosulfonyl-phenoxy)methyl]-1,3,4-oxadiazole Formula: C14H16N4O6S MolecularWeight: 368.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(O1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O6S/c1-10-15-16-14(24-10)9-23-13-5-4-11(8-12(13)18(19)20)25(21,22)17-6-2-3-7-17/h4-5,8H,2-3,6-7,9H2,1H3