2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thieno[3,2-b]azocin-5-one

Systemtic Name: 2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thieno[3,2-b]azocin-5-one Openeye Name: 2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thieno[3,2-b]azocin-5-one CAS Name: 2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thieno[3,2-b]azocin-5-one IUPAC Name: 2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thieno[3,2-b]azocin-5-one Traditional Name: 2-butyl-3-nitro-6,7,8,9-tetrahydro-4H-thien[3,2-b]azocin-5-one Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(S1)CCCCC(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=C(C2=C(S1)CCCCC(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O3S/c1-2-3-6-10-13(15(17)18)12-9(19-10)7-4-5-8-11(16)14-12/h2-8H2,1H3,(H,14,16)