N-[(Z)-(7-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(7-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(7-chloro-1,3-benzodioxol-5-yl)methyleneamino]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-(7-chloro-1,3-benzodioxol-5-yl)methylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(7-chloro-1,3-benzodioxol-5-yl)methylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[(Z)-(7-chloro-1,3-benzodioxol-5-yl)methyleneamino]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C20H17ClN4O4 MolecularWeight: 412.82638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C20H17ClN4O4/c1-11(2)25-20(27)14-6-4-3-5-13(14)17(24-25)19(26)23-22-9-12-7-15(21)18-16(8-12)28-10-29-18/h3-9,11H,10H2,1-2H3,(H,23,26)/b22-9-