1-(3-azanyl-4-azido-6-nitro-1-benzothiophen-2-yl)propan-1-one

Systemtic Name: 1-(3-azanyl-4-azido-6-nitro-1-benzothiophen-2-yl)propan-1-one Openeye Name: 1-(3-amino-4-azido-6-nitro-benzothiophen-2-yl)propan-1-one CAS Name: 1-(3-amino-4-azido-6-nitro-1-benzothiophen-2-yl)-1-propanone IUPAC Name: 1-(3-amino-4-azido-6-nitro-1-benzothiophen-2-yl)propan-1-one Traditional Name: 1-(3-amino-4-azido-6-nitro-benzothiophen-2-yl)propan-1-one Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=C(S1)C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])N

Isomeric SMILES

CCC(=O)C1=C(C2=C(S1)C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])N

InChI

InChI=1S/C11H9N5O3S/c1-2-7(17)11-10(12)9-6(14-15-13)3-5(16(18)19)4-8(9)20-11/h3-4H,2,12H2,1H3