3-nitro-2,4,6-tris(oxidanyl)-N-tetradecyl-benzamide

Systemtic Name: 3-nitro-2,4,6-tris(oxidanyl)-N-tetradecyl-benzamide Openeye Name: 2,4,6-trihydroxy-3-nitro-N-tetradecyl-benzamide CAS Name: 2,4,6-trihydroxy-3-nitro-N-tetradecylbenzamide IUPAC Name: 2,4,6-trihydroxy-3-nitro-N-tetradecylbenzamide Traditional Name: 2,4,6-trihydroxy-N-myristyl-3-nitro-benzamide Formula: C21H34N2O6 MolecularWeight: 410.50446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCNC(=O)C1=C(C(=C(C=C1O)O)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCNC(=O)C1=C(C(=C(C=C1O)O)[N+](=O)[O-])O

InChI

InChI=1S/C21H34N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-21(27)18-16(24)15-17(25)19(20(18)26)23(28)29/h15,24-26H,2-14H2,1H3,(H,22,27)