2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-propan-2-yloxyprop-2-enoic acid

Systemtic Name: 2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-propan-2-yloxyprop-2-enoic acid Openeye Name: 2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-isopropoxyprop-2-enoic acid CAS Name: 2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-propan-2-yloxy-2-propenoic acid IUPAC Name: 2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-propan-2-yloxyprop-2-enoic acid Traditional Name: 2-(3,3-dimethylbut-1-ynyl)naphthalene; (E)-3-isopropoxyacrylic acid Formula: C22H26O3 MolecularWeight: 338.44004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC=CC(=O)O.CC(C)(C)C#CC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)O/C=C/C(=O)O.CC(C)(C)C#CC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C16H16.C6H10O3/c1-16(2,3)11-10-13-8-9-14-6-4-5-7-15(14)12-13;1-5(2)9-4-3-6(7)8/h4-9,12H,1-3H3;3-5H,1-2H3,(H,7,8)/b;4-3+