ethyl 2-[[4,5-bis(chloranyl)-2-nitro-phenyl]amino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4,5-bis(chloranyl)-2-nitro-phenyl]amino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(4,5-dichloro-2-nitro-anilino)benzothiophene-3-carboxylate CAS Name: 2-(4,5-dichloro-2-nitroanilino)-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4,5-dichloro-2-nitroanilino)-1-benzothiophene-3-carboxylate Traditional Name: 2-(4,5-dichloro-2-nitro-anilino)benzothiophene-3-carboxylic acid ethyl ester Formula: C17H12Cl2N2O4S MolecularWeight: 411.25918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC3=CC(=C(C=C3[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC3=CC(=C(C=C3[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C17H12Cl2N2O4S/c1-2-25-17(22)15-9-5-3-4-6-14(9)26-16(15)20-12-7-10(18)11(19)8-13(12)21(23)24/h3-8,20H,2H2,1H3