N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: 2-methyl-3-(4-nitropyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propanamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: 2-methyl-3-(4-nitropyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propionamide Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O3/c1-5-14(3)16-7-9-17(10-8-16)19(6-2)22-20(25)15(4)12-23-13-18(11-21-23)24(26)27/h7-11,13-15,19H,5-6,12H2,1-4H3,(H,22,25)