N-[1-(4-butan-2-ylphenyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propanamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-2-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propionamide Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O4/c1-6-13(3)15-8-10-16(11-9-15)17(7-2)21-19(25)14(4)23-12-18(24(26)27)20(22-23)28-5/h8-14,17H,6-7H2,1-5H3,(H,21,25)