N-(2,4-dimethoxyphenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H23N3O4/c1-13(2)12-24-21(26)16-8-6-5-7-15(16)19(23-24)20(25)22-17-10-9-14(27-3)11-18(17)28-4/h5-11,13H,12H2,1-4H3,(H,22,25)