2-(1-adamantyl)ethyl 3-methylbenzoate

Systemtic Name: 2-(1-adamantyl)ethyl 3-methylbenzoate Openeye Name: 2-(1-adamantyl)ethyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid 2-(1-adamantyl)ethyl ester IUPAC Name: 2-(1-adamantyl)ethyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid 2-(1-adamantyl)ethyl ester Formula: C20H26O2 MolecularWeight: 298.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26O2/c1-14-3-2-4-18(7-14)19(21)22-6-5-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-4,7,15-17H,5-6,8-13H2,1H3