2,2,4-trimethyl-N-(4-methylphenyl)-3-(2,4,6-trinitrophenoxy)pentanamide

Systemtic Name: 2,2,4-trimethyl-N-(4-methylphenyl)-3-(2,4,6-trinitrophenoxy)pentanamide Openeye Name: 2,2,4-trimethyl-N-(p-tolyl)-3-(2,4,6-trinitrophenoxy)pentanamide CAS Name: 2,2,4-trimethyl-N-(4-methylphenyl)-3-(2,4,6-trinitrophenoxy)pentanamide IUPAC Name: 2,2,4-trimethyl-N-(4-methylphenyl)-3-(2,4,6-trinitrophenoxy)pentanamide Traditional Name: 2,2,4-trimethyl-N-(p-tolyl)-3-(2,4,6-trinitrophenoxy)valeramide Formula: C21H24N4O8 MolecularWeight: 460.43726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)(C)C(C(C)C)OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)(C)C(C(C)C)OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O8/c1-12(2)19(21(4,5)20(26)22-14-8-6-13(3)7-9-14)33-18-16(24(29)30)10-15(23(27)28)11-17(18)25(31)32/h6-12,19H,1-5H3,(H,22,26)