4-(1-adamantyl)-3-methyl-2-propan-2-yl-1H-pyrazol-5-one

Systemtic Name: 4-(1-adamantyl)-3-methyl-2-propan-2-yl-1H-pyrazol-5-one Openeye Name: 4-(1-adamantyl)-2-isopropyl-3-methyl-1H-pyrazol-5-one CAS Name: 4-(1-adamantyl)-3-methyl-2-propan-2-yl-1H-pyrazol-5-one IUPAC Name: 4-(1-adamantyl)-3-methyl-2-propan-2-yl-1H-pyrazol-5-one Traditional Name: 4-(1-adamantyl)-1-isopropyl-5-methyl-3-pyrazolin-3-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1C(C)C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C(=O)NN1C(C)C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H26N2O/c1-10(2)19-11(3)15(16(20)18-19)17-7-12-4-13(8-17)6-14(5-12)9-17/h10,12-14H,4-9H2,1-3H3,(H,18,20)