N-(4-butan-2-ylphenyl)-2-chloranyl-3,5-dinitro-benzamide

Systemtic Name: N-(4-butan-2-ylphenyl)-2-chloranyl-3,5-dinitro-benzamide Openeye Name: 2-chloro-3,5-dinitro-N-(4-sec-butylphenyl)benzamide CAS Name: N-(4-butan-2-ylphenyl)-2-chloro-3,5-dinitrobenzamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-chloro-3,5-dinitrobenzamide Traditional Name: 2-chloro-3,5-dinitro-N-(4-sec-butylphenyl)benzamide Formula: C17H16ClN3O5 MolecularWeight: 377.77904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5/c1-3-10(2)11-4-6-12(7-5-11)19-17(22)14-8-13(20(23)24)9-15(16(14)18)21(25)26/h4-10H,3H2,1-2H3,(H,19,22)