N-(1-adamantyl)-2,4-dinitro-benzamide

Systemtic Name: N-(1-adamantyl)-2,4-dinitro-benzamide Openeye Name: N-(1-adamantyl)-2,4-dinitro-benzamide CAS Name: N-(1-adamantyl)-2,4-dinitrobenzamide IUPAC Name: N-(1-adamantyl)-2,4-dinitrobenzamide Traditional Name: N-(1-adamantyl)-2,4-dinitro-benzamide Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5/c21-16(14-2-1-13(19(22)23)6-15(14)20(24)25)18-17-7-10-3-11(8-17)5-12(4-10)9-17/h1-2,6,10-12H,3-5,7-9H2,(H,18,21)