O1-methyl O7-(2-methyl-1-phenyl-propan-2-yl) heptanedioate

Systemtic Name: O1-methyl O7-(2-methyl-1-phenyl-propan-2-yl) heptanedioate Openeye Name: O7-(1,1-dimethyl-2-phenyl-ethyl) O1-methyl heptanedioate CAS Name: heptanedioic acid O1-methyl ester O7-(2-methyl-1-phenylpropan-2-yl) ester IUPAC Name: 1-O-methyl 7-O-(2-methyl-1-phenylpropan-2-yl) heptanedioate Traditional Name: pimelic acid O7-(1,1-dimethyl-2-phenyl-ethyl) ester O1-methyl ester Formula: C18H26O4 MolecularWeight: 306.39664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)OC(=O)CCCCCC(=O)OC

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)OC(=O)CCCCCC(=O)OC

InChI

InChI=1S/C18H26O4/c1-18(2,14-15-10-6-4-7-11-15)22-17(20)13-9-5-8-12-16(19)21-3/h4,6-7,10-11H,5,8-9,12-14H2,1-3H3