1-adamantylmethyl 4-ethylbenzoate

Systemtic Name: 1-adamantylmethyl 4-ethylbenzoate Openeye Name: 1-adamantylmethyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid 1-adamantylmethyl ester Formula: C20H26O2 MolecularWeight: 298.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26O2/c1-2-14-3-5-18(6-4-14)19(21)22-13-20-10-15-7-16(11-20)9-17(8-15)12-20/h3-6,15-17H,2,7-13H2,1H3