1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]prop-2-yn-1-ol

Systemtic Name: 1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]prop-2-yn-1-ol Openeye Name: 1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]prop-2-yn-1-ol CAS Name: 1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]-2-propyn-1-ol IUPAC Name: 1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]prop-2-yn-1-ol Traditional Name: 1-[4-(1-adamantyl)-3-[ethoxy(methoxy)methoxy]phenyl]prop-2-yn-1-ol Formula: C23H30O4 MolecularWeight: 370.4819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(OC)OC1=C(C=CC(=C1)C(C#C)O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(OC)OC1=C(C=CC(=C1)C(C#C)O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H30O4/c1-4-20(24)18-6-7-19(21(11-18)27-22(25-3)26-5-2)23-12-15-8-16(13-23)10-17(9-15)14-23/h1,6-7,11,15-17,20,22,24H,5,8-10,12-14H2,2-3H3