N-(4-butylphenyl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(4-butylphenyl)-2-methyl-3-nitro-benzamide Openeye Name: N-(4-butylphenyl)-2-methyl-3-nitro-benzamide CAS Name: N-(4-butylphenyl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(4-butylphenyl)-2-methyl-3-nitrobenzamide Traditional Name: N-(4-butylphenyl)-2-methyl-3-nitro-benzamide Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3/c1-3-4-6-14-9-11-15(12-10-14)19-18(21)16-7-5-8-17(13(16)2)20(22)23/h5,7-12H,3-4,6H2,1-2H3,(H,19,21)