2-[4-(4-azanylbutyl)phenyl]pyridazin-3-one

Systemtic Name: 2-[4-(4-azanylbutyl)phenyl]pyridazin-3-one Openeye Name: 2-[4-(4-aminobutyl)phenyl]pyridazin-3-one CAS Name: 2-[4-(4-aminobutyl)phenyl]-3-pyridazinone IUPAC Name: 2-[4-(4-aminobutyl)phenyl]pyridazin-3-one Traditional Name: 2-[4-(4-aminobutyl)phenyl]pyridazin-3-one Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(N=C1)C2=CC=C(C=C2)CCCCN

Isomeric SMILES

C1=CC(=O)N(N=C1)C2=CC=C(C=C2)CCCCN

InChI

InChI=1S/C14H17N3O/c15-10-2-1-4-12-6-8-13(9-7-12)17-14(18)5-3-11-16-17/h3,5-9,11H,1-2,4,10,15H2