(E)-3-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-2-enenitrile

Systemtic Name: (E)-3-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-2-enenitrile Openeye Name: (E)-3-(7-heptoxy-1,1,4,4-tetramethyl-tetralin-6-yl)but-2-enenitrile CAS Name: (E)-3-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-butenenitrile IUPAC Name: (E)-3-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-2-enenitrile Traditional Name: (E)-3-(7-heptoxy-1,1,4,4-tetramethyl-tetralin-6-yl)but-2-enenitrile Formula: C25H37NO MolecularWeight: 367.56738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1C(=CC#N)C)C(CCC2(C)C)(C)C

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1/C(=C/C#N)/C)C(CCC2(C)C)(C)C

InChI

InChI=1S/C25H37NO/c1-7-8-9-10-11-16-27-23-18-22-21(17-20(23)19(2)12-15-26)24(3,4)13-14-25(22,5)6/h12,17-18H,7-11,13-14,16H2,1-6H3/b19-12+