3-[1-[5-(4-methylphenyl)carbonyl-1H-pyrrol-2-yl]propyl]-1H-pyridazin-6-one

Systemtic Name: 3-[1-[5-(4-methylphenyl)carbonyl-1H-pyrrol-2-yl]propyl]-1H-pyridazin-6-one Openeye Name: 3-[1-[5-(4-methylbenzoyl)-1H-pyrrol-2-yl]propyl]-1H-pyridazin-6-one CAS Name: 3-[1-[5-[(4-methylphenyl)-oxomethyl]-1H-pyrrol-2-yl]propyl]-1H-pyridazin-6-one IUPAC Name: 3-[1-[5-(4-methylbenzoyl)-1H-pyrrol-2-yl]propyl]-1H-pyridazin-6-one Traditional Name: 3-[1-(5-p-toluoyl-1H-pyrrol-2-yl)propyl]-1H-pyridazin-6-one Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=O)C=C1)C2=CC=C(N2)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C1=NNC(=O)C=C1)C2=CC=C(N2)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H19N3O2/c1-3-14(16-10-11-18(23)22-21-16)15-8-9-17(20-15)19(24)13-6-4-12(2)5-7-13/h4-11,14,20H,3H2,1-2H3,(H,22,23)