N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[2-(3,4-dimethoxyphenyl)-1-methyl-ethylidene]amino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[2-(3,4-dimethoxyphenyl)-1-methyl-ethylidene]amino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C/C(=N/NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N4O4/c1-13(11-14-9-10-17(28-3)18(12-14)29-4)22-23-20(26)19-15-7-5-6-8-16(15)21(27)25(2)24-19/h5-10,12H,11H2,1-4H3,(H,23,26)/b22-13-