N-(5-chloranyl-2-methoxy-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O3/c1-12(2)11-24-20(26)15-7-5-4-6-14(15)18(23-24)19(25)22-16-10-13(21)8-9-17(16)27-3/h4-10,12H,11H2,1-3H3,(H,22,25)