nonyl 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoate

Systemtic Name: nonyl 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoate Openeye Name: nonyl 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]vinyl]benzoate CAS Name: 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoic acid nonyl ester IUPAC Name: nonyl 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoate Traditional Name: 4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]vinyl]benzoic acid nonyl ester Formula: C31H33NO3 MolecularWeight: 467.59862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCCCCCCCCOC(=O)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C31H33NO3/c1-2-3-4-5-6-7-10-23-34-31(33)27-21-17-25(18-22-27)14-13-24-15-19-26(20-16-24)30-32-28-11-8-9-12-29(28)35-30/h8-9,11-22H,2-7,10,23H2,1H3/b14-13+