N-[2-(2,4-dimethylphenoxy)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(2,4-dimethylphenoxy)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(2,4-dimethylphenoxy)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2,4-dimethylphenoxy)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(2,4-dimethylphenoxy)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2,4-dimethylphenoxy)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3/c1-13-8-9-17(14(2)12-13)26-11-10-21-19(24)18-15-6-4-5-7-16(15)20(25)23(3)22-18/h4-9,12H,10-11H2,1-3H3,(H,21,24)