2-ethylhexyl (E)-4,5-bis(oxidanyl)-2-[(E)-2-phenylethenyl]pent-2-enoate

Systemtic Name: 2-ethylhexyl (E)-4,5-bis(oxidanyl)-2-[(E)-2-phenylethenyl]pent-2-enoate Openeye Name: 2-ethylhexyl (E)-4,5-dihydroxy-2-[(E)-styryl]pent-2-enoate CAS Name: (E)-4,5-dihydroxy-2-[(E)-2-phenylethenyl]-2-pentenoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (E)-4,5-dihydroxy-2-[(E)-2-phenylethenyl]pent-2-enoate Traditional Name: (E)-4,5-dihydroxy-2-[(E)-styryl]pent-2-enoic acid 2-ethylhexyl ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=CC(CO)O)C=CC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC)COC(=O)/C(=C/C(CO)O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C21H30O4/c1-3-5-9-17(4-2)16-25-21(24)19(14-20(23)15-22)13-12-18-10-7-6-8-11-18/h6-8,10-14,17,20,22-23H,3-5,9,15-16H2,1-2H3/b13-12+,19-14+