5-butyl-6-chloranyl-3-phenyl-1-(phenylmethyl)pyridazin-4-one

Systemtic Name: 5-butyl-6-chloranyl-3-phenyl-1-(phenylmethyl)pyridazin-4-one Openeye Name: 1-benzyl-5-butyl-6-chloro-3-phenyl-pyridazin-4-one CAS Name: 5-butyl-6-chloro-3-phenyl-1-(phenylmethyl)-4-pyridazinone IUPAC Name: 1-benzyl-5-butyl-6-chloro-3-phenylpyridazin-4-one Traditional Name: 1-benzyl-5-butyl-6-chloro-3-phenyl-pyridazin-4-one Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N=C(C1=O)C2=CC=CC=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCC1=C(N(N=C(C1=O)C2=CC=CC=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O/c1-2-3-14-18-20(25)19(17-12-8-5-9-13-17)23-24(21(18)22)15-16-10-6-4-7-11-16/h4-13H,2-3,14-15H2,1H3