3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Openeye Name: 3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide CAS Name: 3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide IUPAC Name: 3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Traditional Name: 3-(4-methylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Formula: C14H10N2O5S MolecularWeight: 318.3046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O5S/c1-9-2-5-11(6-3-9)21-14-12-7-4-10(16(17)18)8-13(12)22(19,20)15-14/h2-8H,1H3