N-heptan-2-yl-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-heptan-2-yl-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-(1-methylhexyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-heptan-2-yl-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-heptan-2-yl-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(1-methylhexyl)phthalazine-1-carboxamide Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCCCCC(C)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C17H23N3O2/c1-4-5-6-9-12(2)18-16(21)15-13-10-7-8-11-14(13)17(22)20(3)19-15/h7-8,10-12H,4-6,9H2,1-3H3,(H,18,21)