(E)-3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]prop-2-enenitrile

Systemtic Name: (E)-3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]prop-2-enenitrile Openeye Name: (E)-3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-8-propyl-chroman-2-yl]prop-2-enenitrile CAS Name: (E)-3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2-propenenitrile IUPAC Name: (E)-3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]prop-2-enenitrile Traditional Name: (E)-3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-8-propyl-chroman-2-yl]acrylonitrile Formula: C29H35NO5 MolecularWeight: 477.5919

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(CCC(O3)C=CC#N)C=C2)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(CCC(O3)/C=C/C#N)C=C2)CCC

InChI

InChI=1S/C29H35NO5/c1-4-8-24-26(16-14-23(20(3)31)28(24)32)33-18-7-19-34-27-15-12-21-11-13-22(10-6-17-30)35-29(21)25(27)9-5-2/h6,10,12,14-16,22,32H,4-5,7-9,11,13,18-19H2,1-3H3/b10-6+