2-butyl-5-nitro-1,2-benzothiazol-3-one

Systemtic Name: 2-butyl-5-nitro-1,2-benzothiazol-3-one Openeye Name: 2-butyl-5-nitro-1,2-benzothiazol-3-one CAS Name: 2-butyl-5-nitro-1,2-benzothiazol-3-one IUPAC Name: 2-butyl-5-nitro-1,2-benzothiazol-3-one Traditional Name: 2-butyl-5-nitro-1,2-benzothiazol-3-one Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O3S/c1-2-3-6-12-11(14)9-7-8(13(15)16)4-5-10(9)17-12/h4-5,7H,2-3,6H2,1H3