N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-thienyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-thiophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: 5-nitro-N-[3-(piperonylcarbamoyl)-2-thienyl]-2-furamide Formula: C18H13N3O7S MolecularWeight: 415.37672

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(SC=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(SC=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O7S/c22-16(19-8-10-1-2-12-14(7-10)27-9-26-12)11-5-6-29-18(11)20-17(23)13-3-4-15(28-13)21(24)25/h1-7H,8-9H2,(H,19,22)(H,20,23)