N-(1-adamantylmethyl)-N-methyl-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-N-methyl-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(1-adamantylmethyl)-N-methyl-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(1-adamantylmethyl)-N-methyl-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(1-adamantylmethyl)-N-methyl-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(1-adamantylmethyl)-4-keto-N-methyl-3H-phthalazine-1-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H25N3O2/c1-24(12-21-9-13-6-14(10-21)8-15(7-13)11-21)20(26)18-16-4-2-3-5-17(16)19(25)23-22-18/h2-5,13-15H,6-12H2,1H3,(H,23,25)