4-chloranyl-5-[(4-oxidanyl-3-pentoxy-phenyl)methylamino]-2-propan-2-yl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[(4-oxidanyl-3-pentoxy-phenyl)methylamino]-2-propan-2-yl-pyridazin-3-one Openeye Name: 4-chloro-5-[(4-hydroxy-3-pentoxy-phenyl)methylamino]-2-isopropyl-pyridazin-3-one CAS Name: 4-chloro-5-[(4-hydroxy-3-pentoxyphenyl)methylamino]-2-propan-2-yl-3-pyridazinone IUPAC Name: 4-chloro-5-[(4-hydroxy-3-pentoxyphenyl)methylamino]-2-propan-2-ylpyridazin-3-one Traditional Name: 5-[(3-amoxy-4-hydroxy-benzyl)amino]-4-chloro-2-isopropyl-pyridazin-3-one Formula: C19H26ClN3O3 MolecularWeight: 379.88104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)N(N=C2)C(C)C)Cl)O

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)N(N=C2)C(C)C)Cl)O

InChI

InChI=1S/C19H26ClN3O3/c1-4-5-6-9-26-17-10-14(7-8-16(17)24)11-21-15-12-22-23(13(2)3)19(25)18(15)20/h7-8,10,12-13,21,24H,4-6,9,11H2,1-3H3