N-[2-(1-adamantyl)ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-(1-adamantyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(1-adamantyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-(1-adamantyl)ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H25N3O2/c25-19-17-4-2-1-3-16(17)18(23-24-19)20(26)22-6-5-21-10-13-7-14(11-21)9-15(8-13)12-21/h1-4,13-15H,5-12H2,(H,22,26)(H,24,25)