N-(1-adamantylmethyl)-2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide CAS Name: N-(1-adamantylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-(1,4-diketo-3H-phthalazin-2-yl)acetamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C21H25N3O3/c25-18(11-24-20(27)17-4-2-1-3-16(17)19(26)23-24)22-12-21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,13-15H,5-12H2,(H,22,25)(H,23,26)