N'-[3-(2,5-dimethylphenoxy)propanoyl]-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[3-(2,5-dimethylphenoxy)propanoyl]-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-[3-(2,5-dimethylphenoxy)propanoyl]-3-methyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[3-(2,5-dimethylphenoxy)-1-oxopropyl]-3-methyl-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-[3-(2,5-dimethylphenoxy)propanoyl]-3-methyl-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-[3-(2,5-dimethylphenoxy)propanoyl]-4-keto-3-methyl-phthalazine-1-carbohydrazide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

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