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2-(phenylmethyl)hexacosanoate

Systemtic Name:	2-(phenylmethyl)hexacosanoate
Openeye Name:	2-benzylhexacosanoate
CAS Name:	2-(phenylmethyl)hexacosanoate
IUPAC Name:	2-benzylhexacosanoate
Traditional Name:	2-benzylcerotate
Formula:	C₃₃H₅₇O₂-
MolecularWeight:	485.80448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C33H58O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-32(33(34)35)30-31-27-24-23-25-28-31/h23-25,27-28,32H,2-22,26,29-30H2,1H3,(H,34,35)/p-1

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