N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C16H16N2O4S/c1-22-13-7-6-11(18(20)21)9-12(13)17-16(19)15-8-10-4-2-3-5-14(10)23-15/h6-9H,2-5H2,1H3,(H,17,19)