4-chloranyl-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[2-methoxy-4-(propylaminomethyl)phenoxy]-2-phenyl-pyridazin-3-one Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=C(C=C1)OC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

CCCNCC1=CC(=C(C=C1)OC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C21H22ClN3O3/c1-3-11-23-13-15-9-10-17(18(12-15)27-2)28-19-14-24-25(21(26)20(19)22)16-7-5-4-6-8-16/h4-10,12,14,23H,3,11,13H2,1-2H3