N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-thiophene-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-thiophene-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-thiophene-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-3-thiophenecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitrothiophene-3-carboxamide Traditional Name: N-homoveratryl-5-nitro-thiophene-3-carboxamide Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CSC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CSC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H16N2O5S/c1-21-12-4-3-10(7-13(12)22-2)5-6-16-15(18)11-8-14(17(19)20)23-9-11/h3-4,7-9H,5-6H2,1-2H3,(H,16,18)