O1-(3-methylbutyl) O6-(phenylmethyl) hexanedioate

Systemtic Name: O1-(3-methylbutyl) O6-(phenylmethyl) hexanedioate Openeye Name: O6-benzyl O1-isopentyl hexanedioate CAS Name: hexanedioic acid O1-(3-methylbutyl) ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-(3-methylbutyl) hexanedioate Traditional Name: adipic acid O6-benzyl ester O1-isoamyl ester Formula: C18H26O4 MolecularWeight: 306.39664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CCCCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CCOC(=O)CCCCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H26O4/c1-15(2)12-13-21-17(19)10-6-7-11-18(20)22-14-16-8-4-3-5-9-16/h3-5,8-9,15H,6-7,10-14H2,1-2H3