(2-methoxyphenyl)methyl 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-methoxyphenyl)methyl 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: (2-methoxyphenyl)methyl 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid (2-methoxyphenyl)methyl ester IUPAC Name: (2-methoxyphenyl)methyl 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid o-anisyl ester Formula: C17H13NO5S MolecularWeight: 343.35382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO5S/c1-22-14-5-3-2-4-11(14)10-23-17(19)16-9-12-8-13(18(20)21)6-7-15(12)24-16/h2-9H,10H2,1H3