N-[[(1R,3S)-5-oxidanyl-2-adamantylidene]amino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[(1R,3S)-5-oxidanyl-2-adamantylidene]amino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[(1R,3S)-5-hydroxy-2-adamantylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[(1R,3S)-5-hydroxy-2-adamantylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[(1R,3S)-5-hydroxy-2-adamantylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[[(1R,3S)-5-hydroxy-2-adamantylidene]amino]-4-keto-3H-phthalazine-1-carboxamide Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3=NNC(=O)C4=NNC(=O)C5=CC=CC=C54)O

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2=NNC(=O)C4=NNC(=O)C5=CC=CC=C54)CC1C3)O

InChI

InChI=1S/C19H20N4O3/c24-17-14-4-2-1-3-13(14)16(21-22-17)18(25)23-20-15-11-5-10-6-12(15)9-19(26,7-10)8-11/h1-4,10-12,26H,5-9H2,(H,22,24)(H,23,25)/t10?,11-,12+,19?