5-methyl-3-[1-(2-methyl-5-nitro-phenyl)sulfonylpyrrolidin-2-yl]-1,2-oxazole

Systemtic Name: 5-methyl-3-[1-(2-methyl-5-nitro-phenyl)sulfonylpyrrolidin-2-yl]-1,2-oxazole Openeye Name: 5-methyl-3-[1-(2-methyl-5-nitro-phenyl)sulfonylpyrrolidin-2-yl]isoxazole CAS Name: 5-methyl-3-[1-(2-methyl-5-nitrophenyl)sulfonyl-2-pyrrolidinyl]isoxazole IUPAC Name: 5-methyl-3-[1-(2-methyl-5-nitrophenyl)sulfonylpyrrolidin-2-yl]-1,2-oxazole Traditional Name: 5-methyl-3-[1-(2-methyl-5-nitro-phenyl)sulfonylpyrrolidin-2-yl]isoxazole Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC2C3=NOC(=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC2C3=NOC(=C3)C

InChI

InChI=1S/C15H17N3O5S/c1-10-5-6-12(18(19)20)9-15(10)24(21,22)17-7-3-4-14(17)13-8-11(2)23-16-13/h5-6,8-9,14H,3-4,7H2,1-2H3