methyl 3-(1-adamantyl)-4-ethyl-benzoate

Systemtic Name: methyl 3-(1-adamantyl)-4-ethyl-benzoate Openeye Name: methyl 3-(1-adamantyl)-4-ethyl-benzoate CAS Name: 3-(1-adamantyl)-4-ethylbenzoic acid methyl ester IUPAC Name: methyl 3-(1-adamantyl)-4-ethylbenzoate Traditional Name: 3-(1-adamantyl)-4-ethyl-benzoic acid methyl ester Formula: C20H26O2 MolecularWeight: 298.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)OC)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)OC)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26O2/c1-3-16-4-5-17(19(21)22-2)9-18(16)20-10-13-6-14(11-20)8-15(7-13)12-20/h4-5,9,13-15H,3,6-8,10-12H2,1-2H3