3-acetyloxy-3-[3-[1-(1-adamantyl)ethyl]-2-butyl-imidazol-4-yl]propanoate

Systemtic Name: 3-acetyloxy-3-[3-[1-(1-adamantyl)ethyl]-2-butyl-imidazol-4-yl]propanoate Openeye Name: 3-acetoxy-3-[3-[1-(1-adamantyl)ethyl]-2-butyl-imidazol-4-yl]propanoate CAS Name: 3-acetyloxy-3-[3-[1-(1-adamantyl)ethyl]-2-butyl-4-imidazolyl]propanoate IUPAC Name: 3-acetyloxy-3-[3-[1-(1-adamantyl)ethyl]-2-butylimidazol-4-yl]propanoate Traditional Name: 3-acetoxy-3-[3-[1-(1-adamantyl)ethyl]-2-butyl-imidazol-4-yl]propionate Formula: C24H35N2O4- MolecularWeight: 415.5457

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1C(C)C23CC4CC(C2)CC(C4)C3)C(CC(=O)[O-])OC(=O)C

Isomeric SMILES

CCCCC1=NC=C(N1C(C)C23CC4CC(C2)CC(C4)C3)C(CC(=O)[O-])OC(=O)C

InChI

InChI=1S/C24H36N2O4/c1-4-5-6-22-25-14-20(21(10-23(28)29)30-16(3)27)26(22)15(2)24-11-17-7-18(12-24)9-19(8-17)13-24/h14-15,17-19,21H,4-13H2,1-3H3,(H,28,29)/p-1