N-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(4-isobutoxy-3-methoxy-phenyl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-(4-isobutoxy-3-methoxy-benzylidene)amino]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=NNC(=O)C2=NNC(=O)C3=CC=CC=C32)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=N\NC(=O)C2=NNC(=O)C3=CC=CC=C32)OC

InChI

InChI=1S/C21H22N4O4/c1-13(2)12-29-17-9-8-14(10-18(17)28-3)11-22-24-21(27)19-15-6-4-5-7-16(15)20(26)25-23-19/h4-11,13H,12H2,1-3H3,(H,24,27)(H,25,26)/b22-11-