2-adamantyl 4-methylbenzenesulfinate

Systemtic Name: 2-adamantyl 4-methylbenzenesulfinate Openeye Name: 2-adamantyl 4-methylbenzenesulfinate CAS Name: 4-methylbenzenesulfinic acid 2-adamantyl ester IUPAC Name: 2-adamantyl 4-methylbenzenesulfinate Traditional Name: 4-methylbenzenesulfinic acid 2-adamantyl ester Formula: C17H22O2S MolecularWeight: 290.42038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)OC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)OC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C17H22O2S/c1-11-2-4-16(5-3-11)20(18)19-17-14-7-12-6-13(9-14)10-15(17)8-12/h2-5,12-15,17H,6-10H2,1H3