octanoate; phenylmethoxymethylbenzene

Systemtic Name: octanoate; phenylmethoxymethylbenzene Openeye Name: benzyloxymethylbenzene; octanoate CAS Name: octanoate; phenylmethoxymethylbenzene IUPAC Name: octanoate; phenylmethoxymethylbenzene Traditional Name: benzoxymethylbenzene; caprylate Formula: C22H29O3- MolecularWeight: 341.46386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)[O-].C1=CC=C(C=C1)COCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)[O-].C1=CC=C(C=C1)COCC2=CC=CC=C2

InChI

InChI=1S/C14H14O.C8H16O2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;1-2-3-4-5-6-7-8(9)10/h1-10H,11-12H2;2-7H2,1H3,(H,9,10)/p-1