3,4-dimethyl-2,6-dinitro-N-pentan-3-yl-benzamide

Systemtic Name: 3,4-dimethyl-2,6-dinitro-N-pentan-3-yl-benzamide Openeye Name: N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitro-benzamide CAS Name: 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylbenzamide IUPAC Name: 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylbenzamide Traditional Name: N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitro-benzamide Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O5/c1-5-10(6-2)15-14(18)12-11(16(19)20)7-8(3)9(4)13(12)17(21)22/h7,10H,5-6H2,1-4H3,(H,15,18)