1-methyl-4-nitro-3-prop-2-enyl-3H-2,1-benzothiazole 2,2-dioxide

Systemtic Name: 1-methyl-4-nitro-3-prop-2-enyl-3H-2,1-benzothiazole 2,2-dioxide Openeye Name: 3-allyl-1-methyl-4-nitro-3H-2,1-benzothiazole 2,2-dioxide CAS Name: 1-methyl-4-nitro-3-prop-2-enyl-3H-2,1-benzothiazole 2,2-dioxide IUPAC Name: 1-methyl-4-nitro-3-prop-2-enyl-3H-2,1-benzothiazole 2,2-dioxide Traditional Name: 3-allyl-1-methyl-4-nitro-3H-2,1-benzothiazole 2,2-dioxide Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(S1(=O)=O)CC=C)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(C(S1(=O)=O)CC=C)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O4S/c1-3-5-10-11-8(12(2)18(10,16)17)6-4-7-9(11)13(14)15/h3-4,6-7,10H,1,5H2,2H3