2-(phenylcarbonyloxy)ethyl 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: 2-benzoyloxyethyl 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid 2-benzoyloxyethyl ester Formula: C18H13NO6S MolecularWeight: 371.36392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13NO6S/c20-17(12-4-2-1-3-5-12)24-8-9-25-18(21)16-11-13-10-14(19(22)23)6-7-15(13)26-16/h1-7,10-11H,8-9H2