(E)-9,11-dimethyl-2-oxidanyl-12-phenyl-dodec-9-ene-1,2,3-tricarboxylic acid

Systemtic Name: (E)-9,11-dimethyl-2-oxidanyl-12-phenyl-dodec-9-ene-1,2,3-tricarboxylic acid Openeye Name: (E)-2-hydroxy-9,11-dimethyl-12-phenyl-dodec-9-ene-1,2,3-tricarboxylic acid CAS Name: (E)-2-hydroxy-9,11-dimethyl-12-phenyl-9-dodecene-1,2,3-tricarboxylic acid IUPAC Name: (E)-2-hydroxy-9,11-dimethyl-12-phenyldodec-9-ene-1,2,3-tricarboxylic acid Traditional Name: (E)-2-hydroxy-9,11-dimethyl-12-phenyl-dodec-9-ene-1,2,3-tricarboxylic acid Formula: C23H32O7 MolecularWeight: 420.49598

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C=C(C)CCCCCC(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)/C=C(\C)/CCCCCC(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C23H32O7/c1-16(13-17(2)14-18-10-6-4-7-11-18)9-5-3-8-12-19(21(26)27)23(30,22(28)29)15-20(24)25/h4,6-7,10-11,13,17,19,30H,3,5,8-9,12,14-15H2,1-2H3,(H,24,25)(H,26,27)(H,28,29)/b16-13+