3,4-bis[9-(oxiran-2-yl)nonyl]phthalic acid

Systemtic Name: 3,4-bis[9-(oxiran-2-yl)nonyl]phthalic acid Openeye Name: 3,4-bis[9-(oxiran-2-yl)nonyl]phthalic acid CAS Name: 3,4-bis[9-(2-oxiranyl)nonyl]phthalic acid IUPAC Name: 3,4-bis[9-(oxiran-2-yl)nonyl]phthalic acid Traditional Name: 3,4-bis[9-(oxiran-2-yl)nonyl]phthalic acid Formula: C30H46O6 MolecularWeight: 502.68264

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CCCCCCCCCC2=C(C(=C(C=C2)C(=O)O)C(=O)O)CCCCCCCCCC3CO3

Isomeric SMILES

C1C(O1)CCCCCCCCCC2=C(C(=C(C=C2)C(=O)O)C(=O)O)CCCCCCCCCC3CO3

InChI

InChI=1S/C30H46O6/c31-29(32)27-20-19-23(15-11-7-3-1-4-8-12-16-24-21-35-24)26(28(27)30(33)34)18-14-10-6-2-5-9-13-17-25-22-36-25/h19-20,24-25H,1-18,21-22H2,(H,31,32)(H,33,34)