heptyl (E)-2-methyl-4-[2,4,5-trimethyl-3,6-bis(oxidanyl)phenyl]but-2-enoate

Systemtic Name: heptyl (E)-2-methyl-4-[2,4,5-trimethyl-3,6-bis(oxidanyl)phenyl]but-2-enoate Openeye Name: heptyl (E)-4-(2,5-dihydroxy-3,4,6-trimethyl-phenyl)-2-methyl-but-2-enoate CAS Name: (E)-4-(2,5-dihydroxy-3,4,6-trimethylphenyl)-2-methyl-2-butenoic acid heptyl ester IUPAC Name: heptyl (E)-4-(2,5-dihydroxy-3,4,6-trimethylphenyl)-2-methylbut-2-enoate Traditional Name: (E)-4-(2,5-dihydroxy-3,4,6-trimethyl-phenyl)-2-methyl-but-2-enoic acid heptyl ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(=CCC1=C(C(=C(C(=C1C)O)C)C)O)C

Isomeric SMILES

CCCCCCCOC(=O)/C(=C/CC1=C(C(=C(C(=C1C)O)C)C)O)/C

InChI

InChI=1S/C21H32O4/c1-6-7-8-9-10-13-25-21(24)14(2)11-12-18-17(5)19(22)15(3)16(4)20(18)23/h11,22-23H,6-10,12-13H2,1-5H3/b14-11+