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

Systemtic Name: 3-(1-adamantyl)-4-prop-2-enyl-benzoic acid Openeye Name: 3-(1-adamantyl)-4-allyl-benzoic acid CAS Name: 3-(1-adamantyl)-4-prop-2-enylbenzoic acid IUPAC Name: 3-(1-adamantyl)-4-prop-2-enylbenzoic acid Traditional Name: 3-(1-adamantyl)-4-allyl-benzoic acid Formula: C20H24O2 MolecularWeight: 296.40336

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=C(C=C1)C(=O)O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCC1=C(C=C(C=C1)C(=O)O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H24O2/c1-2-3-16-4-5-17(19(21)22)9-18(16)20-10-13-6-14(11-20)8-15(7-13)12-20/h2,4-5,9,13-15H,1,3,6-8,10-12H2,(H,21,22)