N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-nitro-benzamide Openeye Name: 2-methyl-3-nitro-N-[1-(4-sec-butylphenyl)propyl]benzamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-nitrobenzamide Traditional Name: 2-methyl-3-nitro-N-[1-(4-sec-butylphenyl)propyl]benzamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-5-14(3)16-10-12-17(13-11-16)19(6-2)22-21(24)18-8-7-9-20(15(18)4)23(25)26/h7-14,19H,5-6H2,1-4H3,(H,22,24)