N-(4-butylphenyl)-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(4-butylphenyl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(4-butylphenyl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(4-butylphenyl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(4-butylphenyl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(4-butylphenyl)-2-methyl-3,5-dinitro-benzamide Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-3-4-5-13-6-8-14(9-7-13)19-18(22)16-10-15(20(23)24)11-17(12(16)2)21(25)26/h6-11H,3-5H2,1-2H3,(H,19,22)