methyl 3-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(5-chloro-2-nitro-benzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[(5-chloro-2-nitrophenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-nitrobenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(5-chloro-2-nitro-benzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H11ClN2O5S MolecularWeight: 390.79764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H11ClN2O5S/c1-25-17(22)15-14(10-4-2-3-5-13(10)26-15)19-16(21)11-8-9(18)6-7-12(11)20(23)24/h2-8H,1H3,(H,19,21)