[4-[(E)-2-(5-bromanyl-6-octoxy-naphthalen-2-yl)ethenyl]phenyl] ethanoate

Systemtic Name: [4-[(E)-2-(5-bromanyl-6-octoxy-naphthalen-2-yl)ethenyl]phenyl] ethanoate Openeye Name: [4-[(E)-2-(5-bromo-6-octoxy-2-naphthyl)vinyl]phenyl] acetate CAS Name: acetic acid [4-[(E)-2-(5-bromo-6-octoxy-2-naphthalenyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(5-bromo-6-octoxynaphthalen-2-yl)ethenyl]phenyl] acetate Traditional Name: acetic acid [4-[(E)-2-(5-bromo-6-octoxy-2-naphthyl)vinyl]phenyl] ester Formula: C28H31BrO3 MolecularWeight: 495.44794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C1)C=C(C=C2)C=CC3=CC=C(C=C3)OC(=O)C)Br

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C1)C=C(C=C2)/C=C/C3=CC=C(C=C3)OC(=O)C)Br

InChI

InChI=1S/C28H31BrO3/c1-3-4-5-6-7-8-19-31-27-18-14-24-20-23(13-17-26(24)28(27)29)10-9-22-11-15-25(16-12-22)32-21(2)30/h9-18,20H,3-8,19H2,1-2H3/b10-9+