(2-oxidanylidene-2-phenylazanyl-ethyl) 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C17H12N2O5S MolecularWeight: 356.35258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O5S/c20-16(18-12-4-2-1-3-5-12)10-24-17(21)15-9-11-8-13(19(22)23)6-7-14(11)25-15/h1-9H,10H2,(H,18,20)