(2-methyl-2-adamantyl) 2-ethyl-2-methyl-4-[4-(1-propan-2-yloxyethoxy)phenyl]pentanoate

Systemtic Name: (2-methyl-2-adamantyl) 2-ethyl-2-methyl-4-[4-(1-propan-2-yloxyethoxy)phenyl]pentanoate Openeye Name: (2-methyl-2-adamantyl) 2-ethyl-4-[4-(1-isopropoxyethoxy)phenyl]-2-methyl-pentanoate CAS Name: 2-ethyl-2-methyl-4-[4-(1-propan-2-yloxyethoxy)phenyl]pentanoic acid (2-methyl-2-adamantyl) ester IUPAC Name: (2-methyl-2-adamantyl) 2-ethyl-2-methyl-4-[4-(1-propan-2-yloxyethoxy)phenyl]pentanoate Traditional Name: 2-ethyl-4-[4-(1-isopropoxyethoxy)phenyl]-2-methyl-valeric acid (2-methyl-2-adamantyl) ester Formula: C30H46O4 MolecularWeight: 470.68384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)C1=CC=C(C=C1)OC(C)OC(C)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CCC(C)(CC(C)C1=CC=C(C=C1)OC(C)OC(C)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C30H46O4/c1-8-29(6,18-20(4)24-9-11-27(12-10-24)33-21(5)32-19(2)3)28(31)34-30(7)25-14-22-13-23(16-25)17-26(30)15-22/h9-12,19-23,25-26H,8,13-18H2,1-7H3