O1-hexadecyl O6-phenyl hexanedioate

Systemtic Name: O1-hexadecyl O6-phenyl hexanedioate Openeye Name: O1-hexadecyl O6-phenyl hexanedioate CAS Name: hexanedioic acid O1-hexadecyl ester O6-phenyl ester IUPAC Name: 1-O-hexadecyl 6-O-phenyl hexanedioate Traditional Name: adipic acid O1-cetyl ester O6-phenyl ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C28H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-25-31-27(29)23-18-19-24-28(30)32-26-21-16-15-17-22-26/h15-17,21-22H,2-14,18-20,23-25H2,1H3