(phenylmethyl) 5-(6,6-dimethylheptanoylamino)-3,3-dimethoxy-pentanoate

Systemtic Name: (phenylmethyl) 5-(6,6-dimethylheptanoylamino)-3,3-dimethoxy-pentanoate Openeye Name: benzyl 5-(6,6-dimethylheptanoylamino)-3,3-dimethoxy-pentanoate CAS Name: 5-[(6,6-dimethyl-1-oxoheptyl)amino]-3,3-dimethoxypentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(6,6-dimethylheptanoylamino)-3,3-dimethoxypentanoate Traditional Name: 5-(6,6-dimethylheptanoylamino)-3,3-dimethoxy-valeric acid benzyl ester Formula: C23H37NO5 MolecularWeight: 407.54358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCC(=O)NCCC(CC(=O)OCC1=CC=CC=C1)(OC)OC

Isomeric SMILES

CC(C)(C)CCCCC(=O)NCCC(CC(=O)OCC1=CC=CC=C1)(OC)OC

InChI

InChI=1S/C23H37NO5/c1-22(2,3)14-10-9-13-20(25)24-16-15-23(27-4,28-5)17-21(26)29-18-19-11-7-6-8-12-19/h6-8,11-12H,9-10,13-18H2,1-5H3,(H,24,25)