(E)-4-[4-(1-adamantyl)phenoxy]but-2-enoic acid

Systemtic Name: (E)-4-[4-(1-adamantyl)phenoxy]but-2-enoic acid Openeye Name: (E)-4-[4-(1-adamantyl)phenoxy]but-2-enoic acid CAS Name: (E)-4-[4-(1-adamantyl)phenoxy]-2-butenoic acid IUPAC Name: (E)-4-[4-(1-adamantyl)phenoxy]but-2-enoic acid Traditional Name: (E)-4-[4-(1-adamantyl)phenoxy]but-2-enoic acid Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCC=CC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OC/C=C/C(=O)O

InChI

InChI=1S/C20H24O3/c21-19(22)2-1-7-23-18-5-3-17(4-6-18)20-11-14-8-15(12-20)10-16(9-14)13-20/h1-6,14-16H,7-13H2,(H,21,22)/b2-1+