N-[(4-ethoxy-3-methoxy-phenyl)methyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-5-nitro-benzothiophene-2-carboxamide Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18N2O5S/c1-3-26-15-6-4-12(8-16(15)25-2)11-20-19(22)18-10-13-9-14(21(23)24)5-7-17(13)27-18/h4-10H,3,11H2,1-2H3,(H,20,22)