2-(1-adamantyl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(1-adamantyl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(1-adamantyl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(1-adamantyl)ethyl ester IUPAC Name: 2-(1-adamantyl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(1-adamantyl)ethyl ester Formula: C19H26O3S MolecularWeight: 334.47294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26O3S/c1-14-2-4-18(5-3-14)23(20,21)22-7-6-19-11-15-8-16(12-19)10-17(9-15)13-19/h2-5,15-17H,6-13H2,1H3