N-(6-nitro-1,3-benzothiazol-2-yl)octanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)octanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)octanamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)octanamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)octanamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)caprylamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3S/c1-2-3-4-5-6-7-14(19)17-15-16-12-9-8-11(18(20)21)10-13(12)22-15/h8-10H,2-7H2,1H3,(H,16,17,19)