2-(4-chlorophenyl)-4-[2-(2-methylpropylamino)ethanoyl]-5-propyl-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropylamino)ethanoyl]-5-propyl-1H-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-4-[2-(isobutylamino)acetyl]-5-propyl-1H-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropylamino)-1-oxoethyl]-5-propyl-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropylamino)acetyl]-5-propyl-1H-pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-4-[2-(isobutylamino)acetyl]-5-propyl-3-pyrazolin-3-one Formula: C18H24ClN3O2 MolecularWeight: 349.85506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C(=O)CNCC(C)C

Isomeric SMILES

CCCC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C(=O)CNCC(C)C

InChI

InChI=1S/C18H24ClN3O2/c1-4-5-15-17(16(23)11-20-10-12(2)3)18(24)22(21-15)14-8-6-13(19)7-9-14/h6-9,12,20-21H,4-5,10-11H2,1-3H3