4-(1-adamantyl)-1,2,5-trimethyl-pyrazol-3-one

Systemtic Name: 4-(1-adamantyl)-1,2,5-trimethyl-pyrazol-3-one Openeye Name: 4-(1-adamantyl)-1,2,5-trimethyl-pyrazol-3-one CAS Name: 4-(1-adamantyl)-1,2,5-trimethyl-3-pyrazolone IUPAC Name: 4-(1-adamantyl)-1,2,5-trimethylpyrazol-3-one Traditional Name: 4-(1-adamantyl)-1,2,5-trimethyl-3-pyrazolin-3-one Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C(=O)N(N1C)C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H24N2O/c1-10-14(15(19)18(3)17(10)2)16-7-11-4-12(8-16)6-13(5-11)9-16/h11-13H,4-9H2,1-3H3