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

Systemtic Name: (2-methoxyphenyl) 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: (2-methoxyphenyl) 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid (2-methoxyphenyl) ester Formula: C16H11NO5S MolecularWeight: 329.32724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO5S/c1-21-12-4-2-3-5-13(12)22-16(18)15-9-10-8-11(17(19)20)6-7-14(10)23-15/h2-9H,1H3