N-(2-methyl-6-propan-2-yl-phenyl)-2,4-dinitro-benzamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2,4-dinitro-benzamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2,4-dinitro-benzamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2,4-dinitrobenzamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2,4-dinitrobenzamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2,4-dinitro-benzamide Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5/c1-10(2)13-6-4-5-11(3)16(13)18-17(21)14-8-7-12(19(22)23)9-15(14)20(24)25/h4-10H,1-3H3,(H,18,21)