N-[(E)-3-(butylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide

Systemtic Name: N-[(E)-3-(butylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide Openeye Name: N-[(E)-1-(butylcarbamoyl)-2-(3-nitrophenyl)vinyl]furan-2-carboxamide CAS Name: N-[(E)-3-(butylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-furancarboxamide IUPAC Name: N-[(E)-3-(butylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide Traditional Name: N-[(E)-1-(butylcarbamoyl)-2-(3-nitrophenyl)vinyl]-2-furamide Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CO2

Isomeric SMILES

CCCCNC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H19N3O5/c1-2-3-9-19-17(22)15(20-18(23)16-8-5-10-26-16)12-13-6-4-7-14(11-13)21(24)25/h4-8,10-12H,2-3,9H2,1H3,(H,19,22)(H,20,23)/b15-12+