N-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3/c1-22(2,3)15-9-11-16(12-10-15)28-14-13-23-20(26)19-17-7-5-6-8-18(17)21(27)25(4)24-19/h5-12H,13-14H2,1-4H3,(H,23,26)