4-nitro-N-(7-nitro-6-oxidanylidene-heptyl)benzamide

Systemtic Name: 4-nitro-N-(7-nitro-6-oxidanylidene-heptyl)benzamide Openeye Name: 4-nitro-N-(7-nitro-6-oxo-heptyl)benzamide CAS Name: 4-nitro-N-(7-nitro-6-oxoheptyl)benzamide IUPAC Name: 4-nitro-N-(7-nitro-6-oxoheptyl)benzamide Traditional Name: N-(6-keto-7-nitro-heptyl)-4-nitro-benzamide Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCCCC(=O)C[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCCCC(=O)C[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c18-13(10-16(20)21)4-2-1-3-9-15-14(19)11-5-7-12(8-6-11)17(22)23/h5-8H,1-4,9-10H2,(H,15,19)