6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide Openeye Name: 6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide CAS Name: 6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide IUPAC Name: 6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide Traditional Name: 6-nitro-3-(2-propylphenoxy)-1,2-benzothiazole 1,1-dioxide Formula: C16H14N2O5S MolecularWeight: 346.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=CC=C1OC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O5S/c1-2-5-11-6-3-4-7-14(11)23-16-13-9-8-12(18(19)20)10-15(13)24(21,22)17-16/h3-4,6-10H,2,5H2,1H3