3-(1-adamantyl)-4-methoxy-benzenethiol

Systemtic Name: 3-(1-adamantyl)-4-methoxy-benzenethiol Openeye Name: 3-(1-adamantyl)-4-methoxy-benzenethiol CAS Name: 3-(1-adamantyl)-4-methoxybenzenethiol IUPAC Name: 3-(1-adamantyl)-4-methoxybenzenethiol Traditional Name: 3-(1-adamantyl)-4-methoxy-benzenethiol Formula: C17H22OS MolecularWeight: 274.42098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=C(C=C1)S)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H22OS/c1-18-16-3-2-14(19)7-15(16)17-8-11-4-12(9-17)6-13(5-11)10-17/h2-3,7,11-13,19H,4-6,8-10H2,1H3