N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-pyrrolidin-1-yl-phenyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-chloro-2-(1-pyrrolidinyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-chloro-2-pyrrolidin-1-ylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-pyrrolidino-phenyl)-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCC4

InChI

InChI=1S/C20H19ClN4O2/c1-24-20(27)15-7-3-2-6-14(15)18(23-24)19(26)22-16-12-13(21)8-9-17(16)25-10-4-5-11-25/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,22,26)