2-[3-(3-butyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid

Systemtic Name: 2-[3-(3-butyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid Openeye Name: 2-[3-(7-butyl-1,1,4,4-tetramethyl-tetralin-6-yl)phenyl]prop-2-enoic acid CAS Name: 2-[3-(3-butyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]-2-propenoic acid IUPAC Name: 2-[3-(3-butyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid Traditional Name: 2-[3-(7-butyl-1,1,4,4-tetramethyl-tetralin-6-yl)phenyl]acrylic acid Formula: C27H34O2 MolecularWeight: 390.55766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1C3=CC(=CC=C3)C(=C)C(=O)O)C(CCC2(C)C)(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1C3=CC(=CC=C3)C(=C)C(=O)O)C(CCC2(C)C)(C)C

InChI

InChI=1S/C27H34O2/c1-7-8-10-21-16-23-24(27(5,6)14-13-26(23,3)4)17-22(21)20-12-9-11-19(15-20)18(2)25(28)29/h9,11-12,15-17H,2,7-8,10,13-14H2,1,3-6H3,(H,28,29)