(E)-3-(5,5,8,8-tetramethyl-3-propoxy-6,7-dihydronaphthalen-1-yl)but-2-enenitrile

Systemtic Name: (E)-3-(5,5,8,8-tetramethyl-3-propoxy-6,7-dihydronaphthalen-1-yl)but-2-enenitrile Openeye Name: (E)-3-(1,1,4,4-tetramethyl-7-propoxy-tetralin-5-yl)but-2-enenitrile CAS Name: (E)-3-(5,5,8,8-tetramethyl-3-propoxy-6,7-dihydronaphthalen-1-yl)-2-butenenitrile IUPAC Name: (E)-3-(5,5,8,8-tetramethyl-3-propoxy-6,7-dihydronaphthalen-1-yl)but-2-enenitrile Traditional Name: (E)-3-(1,1,4,4-tetramethyl-7-propoxy-tetralin-5-yl)but-2-enenitrile Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C(=C1)C(=CC#N)C)C(CCC2(C)C)(C)C

Isomeric SMILES

CCCOC1=CC2=C(C(=C1)/C(=C/C#N)/C)C(CCC2(C)C)(C)C

InChI

InChI=1S/C21H29NO/c1-7-12-23-16-13-17(15(2)8-11-22)19-18(14-16)20(3,4)9-10-21(19,5)6/h8,13-14H,7,9-10,12H2,1-6H3/b15-8+