N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C20H20ClN3O4/c1-4-9-24-20(26)13-8-6-5-7-12(13)18(23-24)19(25)22-15-10-14(21)16(27-2)11-17(15)28-3/h5-8,10-11H,4,9H2,1-3H3,(H,22,25)