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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

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