N-(2-ethylphenyl)-4-methoxy-3,5-dinitro-benzamide

Systemtic Name: N-(2-ethylphenyl)-4-methoxy-3,5-dinitro-benzamide Openeye Name: N-(2-ethylphenyl)-4-methoxy-3,5-dinitro-benzamide CAS Name: N-(2-ethylphenyl)-4-methoxy-3,5-dinitrobenzamide IUPAC Name: N-(2-ethylphenyl)-4-methoxy-3,5-dinitrobenzamide Traditional Name: N-(2-ethylphenyl)-4-methoxy-3,5-dinitro-benzamide Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])OC)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O6/c1-3-10-6-4-5-7-12(10)17-16(20)11-8-13(18(21)22)15(25-2)14(9-11)19(23)24/h4-9H,3H2,1-2H3,(H,17,20)