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

Systemtic Name: N-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(E)-(4-isobutoxy-3-methoxy-phenyl)methyleneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(E)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(E)-(4-isobutoxy-3-methoxy-benzylidene)amino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c1-14(2)13-30-18-10-9-15(11-19(18)29-4)12-23-24-21(27)20-16-7-5-6-8-17(16)22(28)26(3)25-20/h5-12,14H,13H2,1-4H3,(H,24,27)/b23-12+