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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O5/c1-4-11(2)13-5-7-14(8-6-13)19-18(22)16-9-15(20(23)24)10-17(12(16)3)21(25)26/h5-11H,4H2,1-3H3,(H,19,22)