O1-butyl O4-hexadecyl benzene-1,4-dicarboxylate

Systemtic Name: O1-butyl O4-hexadecyl benzene-1,4-dicarboxylate Openeye Name: O1-butyl O4-hexadecyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-hexadecyl ester IUPAC Name: 1-O-butyl 4-O-hexadecyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-cetyl ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC

InChI

InChI=1S/C28H46O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-24-32-28(30)26-21-19-25(20-22-26)27(29)31-23-6-4-2/h19-22H,3-18,23-24H2,1-2H3