N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(4-nitrophenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(4-nitrophenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[(4-nitrophenyl)carbamoyl]vinyl]furan-2-carboxamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]-2-furancarboxamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]furan-2-carboxamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[(4-nitrophenyl)carbamoyl]vinyl]-2-furamide Formula: C21H15N3O7 MolecularWeight: 421.3597

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])/NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H15N3O7/c25-20(22-14-4-6-15(7-5-14)24(27)28)16(23-21(26)18-2-1-9-29-18)10-13-3-8-17-19(11-13)31-12-30-17/h1-11H,12H2,(H,22,25)(H,23,26)/b16-10+