O1-(phenylmethyl) O6-(phenylsulfanylmethyl) hexanedioate

Systemtic Name: O1-(phenylmethyl) O6-(phenylsulfanylmethyl) hexanedioate Openeye Name: O1-benzyl O6-(phenylsulfanylmethyl) hexanedioate CAS Name: hexanedioic acid O1-(phenylmethyl) ester O6-[(phenylthio)methyl] ester IUPAC Name: 1-O-benzyl 6-O-(phenylsulfanylmethyl) hexanedioate Traditional Name: adipic acid O1-benzyl ester O6-[(phenylthio)methyl] ester Formula: C20H22O4S MolecularWeight: 358.45128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCSC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCSC2=CC=CC=C2

InChI

InChI=1S/C20H22O4S/c21-19(23-15-17-9-3-1-4-10-17)13-7-8-14-20(22)24-16-25-18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2