3-(1-adamantyl)-4-prop-2-enoxy-benzoic acid

Systemtic Name: 3-(1-adamantyl)-4-prop-2-enoxy-benzoic acid Openeye Name: 3-(1-adamantyl)-4-allyloxy-benzoic acid CAS Name: 3-(1-adamantyl)-4-prop-2-enoxybenzoic acid IUPAC Name: 3-(1-adamantyl)-4-prop-2-enoxybenzoic acid Traditional Name: 3-(1-adamantyl)-4-allyloxy-benzoic acid Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)C(=O)O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)C(=O)O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H24O3/c1-2-5-23-18-4-3-16(19(21)22)9-17(18)20-10-13-6-14(11-20)8-15(7-13)12-20/h2-4,9,13-15H,1,5-8,10-12H2,(H,21,22)