N-[1-(4-butan-2-ylphenyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]butanamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]butyramide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(CC)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(CC)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C21H30N4O3/c1-6-14(4)16-9-11-17(12-10-16)18(7-2)22-21(26)19(8-3)24-15(5)13-20(23-24)25(27)28/h9-14,18-19H,6-8H2,1-5H3,(H,22,26)