[1,1,4,4-tetramethyl-7-[(E)-1-phenylprop-1-en-2-yl]-2,3-dihydronaphthalen-2-yl] pentanoate

Systemtic Name: [1,1,4,4-tetramethyl-7-[(E)-1-phenylprop-1-en-2-yl]-2,3-dihydronaphthalen-2-yl] pentanoate Openeye Name: [1,1,4,4-tetramethyl-7-[(E)-1-methyl-2-phenyl-vinyl]tetralin-2-yl] pentanoate CAS Name: pentanoic acid [1,1,4,4-tetramethyl-7-[(E)-1-phenylprop-1-en-2-yl]-2,3-dihydronaphthalen-2-yl] ester IUPAC Name: [1,1,4,4-tetramethyl-7-[(E)-1-phenylprop-1-en-2-yl]-2,3-dihydronaphthalen-2-yl] pentanoate Traditional Name: valeric acid [1,1,4,4-tetramethyl-7-[(E)-1-methyl-2-phenyl-vinyl]tetralin-2-yl] ester Formula: C28H36O2 MolecularWeight: 404.58424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1CC(C2=C(C1(C)C)C=C(C=C2)C(=CC3=CC=CC=C3)C)(C)C

Isomeric SMILES

CCCCC(=O)OC1CC(C2=C(C1(C)C)C=C(C=C2)/C(=C/C3=CC=CC=C3)/C)(C)C

InChI

InChI=1S/C28H36O2/c1-7-8-14-26(29)30-25-19-27(3,4)23-16-15-22(18-24(23)28(25,5)6)20(2)17-21-12-10-9-11-13-21/h9-13,15-18,25H,7-8,14,19H2,1-6H3/b20-17+