ethyl 2-[[5,7-bis(chloranyl)-2-nitro-1-benzothiophen-3-yl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[[5,7-bis(chloranyl)-2-nitro-1-benzothiophen-3-yl]amino]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[(5,7-dichloro-2-nitro-benzothiophen-3-yl)amino]-2-oxo-acetate CAS Name: 2-[(5,7-dichloro-2-nitro-1-benzothiophen-3-yl)amino]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[(5,7-dichloro-2-nitro-1-benzothiophen-3-yl)amino]-2-oxoacetate Traditional Name: 2-[(5,7-dichloro-2-nitro-benzothiophen-3-yl)amino]-2-keto-acetic acid ethyl ester Formula: C12H8Cl2N2O5S MolecularWeight: 363.17332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=C(SC2=C(C=C(C=C12)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)NC1=C(SC2=C(C=C(C=C12)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8Cl2N2O5S/c1-2-21-12(18)10(17)15-8-6-3-5(13)4-7(14)9(6)22-11(8)16(19)20/h3-4H,2H2,1H3,(H,15,17)