4-[3-butoxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid

Systemtic Name: 4-[3-butoxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid Openeye Name: 4-[3-butoxy-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]benzoic acid CAS Name: 4-[3-butoxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid IUPAC Name: 4-[3-butoxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-ynyl]benzoic acid Traditional Name: 4-[3-butoxy-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-ynyl]benzoic acid Formula: C28H34O3 MolecularWeight: 418.56776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C#CC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

Isomeric SMILES

CCCCOC(C#CC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

InChI

InChI=1S/C28H34O3/c1-6-7-18-31-25(15-10-20-8-11-21(12-9-20)26(29)30)22-13-14-23-24(19-22)28(4,5)17-16-27(23,2)3/h8-9,11-14,19,25H,6-7,16-18H2,1-5H3,(H,29,30)