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

Systemtic Name: O1-butyl O4-octadecyl benzene-1,4-dicarboxylate Openeye Name: O1-butyl O4-octadecyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-octadecyl ester IUPAC Name: 1-O-butyl 4-O-octadecyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-stearyl ester Formula: C30H50O4 MolecularWeight: 474.7156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H50O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-34-30(32)28-23-21-27(22-24-28)29(31)33-25-6-4-2/h21-24H,3-20,25-26H2,1-2H3