5-chloranyl-4-[(3,4-dimethoxyphenyl)methylamino]-3-pentoxy-1H-pyridazin-6-one; N,N-diethylmethanamide

Systemtic Name: 5-chloranyl-4-[(3,4-dimethoxyphenyl)methylamino]-3-pentoxy-1H-pyridazin-6-one; N,N-diethylmethanamide Openeye Name: 5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-3-pentoxy-1H-pyridazin-6-one; N,N-diethylformamide CAS Name: 5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-3-pentoxy-1H-pyridazin-6-one; N,N-diethylformamide IUPAC Name: 5-chloro-4-[(3,4-dimethoxyphenyl)methylamino]-3-pentoxy-1H-pyridazin-6-one; N,N-diethylformamide Traditional Name: 3-amoxy-5-chloro-4-(veratrylamino)-1H-pyridazin-6-one; N,N-diethylformamide Formula: C23H35ClN4O5 MolecularWeight: 483.0008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NNC(=O)C(=C1NCC2=CC(=C(C=C2)OC)OC)Cl.CCN(CC)C=O

Isomeric SMILES

CCCCCOC1=NNC(=O)C(=C1NCC2=CC(=C(C=C2)OC)OC)Cl.CCN(CC)C=O

InChI

InChI=1S/C18H24ClN3O4.C5H11NO/c1-4-5-6-9-26-18-16(15(19)17(23)21-22-18)20-11-12-7-8-13(24-2)14(10-12)25-3;1-3-6(4-2)5-7/h7-8,10H,4-6,9,11H2,1-3H3,(H2,20,21,23);5H,3-4H2,1-2H3