3-(5-methyl-2-propan-2-yl-phenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 3-(5-methyl-2-propan-2-yl-phenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Openeye Name: 3-(2-isopropyl-5-methyl-phenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide CAS Name: 3-(5-methyl-2-propan-2-ylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide IUPAC Name: 3-(5-methyl-2-propan-2-ylphenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Traditional Name: 3-(2-isopropyl-5-methyl-phenoxy)-6-nitro-1,2-benzothiazole 1,1-dioxide Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S/c1-10(2)13-6-4-11(3)8-15(13)24-17-14-7-5-12(19(20)21)9-16(14)25(22,23)18-17/h4-10H,1-3H3