3,5-dimethyl-4-[(6-nitro-2,3-dihydroindol-1-yl)sulfonyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[(6-nitro-2,3-dihydroindol-1-yl)sulfonyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-(6-nitroindolin-1-yl)sulfonyl-isoxazole CAS Name: 3,5-dimethyl-4-[(6-nitro-2,3-dihydroindol-1-yl)sulfonyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[(6-nitro-2,3-dihydroindol-1-yl)sulfonyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-(6-nitroindolin-1-yl)sulfonyl-isoxazole Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5S/c1-8-13(9(2)21-14-8)22(19,20)15-6-5-10-3-4-11(16(17)18)7-12(10)15/h3-4,7H,5-6H2,1-2H3