4-oxidanylidene-N-pentyl-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-pentyl-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-pentyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-pentyl-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-pentyl-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-amyl-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C17H23N3O2 MolecularWeight: 301.38342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C(C)C

Isomeric SMILES

CCCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C(C)C

InChI

InChI=1S/C17H23N3O2/c1-4-5-8-11-18-16(21)15-13-9-6-7-10-14(13)17(22)20(19-15)12(2)3/h6-7,9-10,12H,4-5,8,11H2,1-3H3,(H,18,21)