N,N'-bis(3-methylbutyl)-2-[(5-nitrofuran-2-yl)methylidene]propanediamide

Systemtic Name: N,N'-bis(3-methylbutyl)-2-[(5-nitrofuran-2-yl)methylidene]propanediamide Openeye Name: N,N'-diisopentyl-2-[(5-nitro-2-furyl)methylene]propanediamide CAS Name: N,N'-bis(3-methylbutyl)-2-[(5-nitro-2-furanyl)methylidene]propanediamide IUPAC Name: N,N'-bis(3-methylbutyl)-2-[(5-nitrofuran-2-yl)methylidene]propanediamide Traditional Name: N,N'-diisoamyl-2-[(5-nitro-2-furyl)methylene]malonamide Formula: C18H27N3O5 MolecularWeight: 365.42408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(=CC1=CC=C(O1)[N+](=O)[O-])C(=O)NCCC(C)C

Isomeric SMILES

CC(C)CCNC(=O)C(=CC1=CC=C(O1)[N+](=O)[O-])C(=O)NCCC(C)C

InChI

InChI=1S/C18H27N3O5/c1-12(2)7-9-19-17(22)15(18(23)20-10-8-13(3)4)11-14-5-6-16(26-14)21(24)25/h5-6,11-13H,7-10H2,1-4H3,(H,19,22)(H,20,23)