3-nitro-N-(pentan-3-ylideneamino)benzamide

Systemtic Name: 3-nitro-N-(pentan-3-ylideneamino)benzamide Openeye Name: N-(1-ethylpropylideneamino)-3-nitro-benzamide CAS Name: 3-nitro-N-(pentan-3-ylideneamino)benzamide IUPAC Name: 3-nitro-N-(pentan-3-ylideneamino)benzamide Traditional Name: N-(1-ethylpropylideneamino)-3-nitro-benzamide Formula: C12H15N3O3 MolecularWeight: 249.2658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])CC

Isomeric SMILES

CCC(=NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])CC

InChI

InChI=1S/C12H15N3O3/c1-3-10(4-2)13-14-12(16)9-6-5-7-11(8-9)15(17)18/h5-8H,3-4H2,1-2H3,(H,14,16)