3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-4-oxo-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-4-oxo-N-(2-oxo-2-pyrrolidin-1-ylethyl)phthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-4-keto-N-(2-keto-2-pyrrolidino-ethyl)phthalazine-1-carboxamide Formula: C22H21ClN4O4 MolecularWeight: 440.87954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCCC4)Cl

InChI

InChI=1S/C22H21ClN4O4/c1-31-18-9-8-14(12-17(18)23)27-22(30)16-7-3-2-6-15(16)20(25-27)21(29)24-13-19(28)26-10-4-5-11-26/h2-3,6-9,12H,4-5,10-11,13H2,1H3,(H,24,29)