[(4R)-4-(4-methoxy-3-oxidanyl-phenyl)-4-(naphthalen-1-ylcarbamoyloxy)butyl] 2-sulfanylethanoate

Systemtic Name: [(4R)-4-(4-methoxy-3-oxidanyl-phenyl)-4-(naphthalen-1-ylcarbamoyloxy)butyl] 2-sulfanylethanoate Openeye Name: [(4R)-4-(3-hydroxy-4-methoxy-phenyl)-4-(1-naphthylcarbamoyloxy)butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(4R)-4-(3-hydroxy-4-methoxyphenyl)-4-[(1-naphthalenylamino)-oxomethoxy]butyl] ester IUPAC Name: [(4R)-4-(3-hydroxy-4-methoxyphenyl)-4-(naphthalen-1-ylcarbamoyloxy)butyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(4R)-4-(3-hydroxy-4-methoxy-phenyl)-4-(1-naphthylcarbamoyloxy)butyl] ester Formula: C24H25NO6S MolecularWeight: 455.5234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCCOC(=O)CS)OC(=O)NC2=CC=CC3=CC=CC=C32)O

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](CCCOC(=O)CS)OC(=O)NC2=CC=CC3=CC=CC=C32)O

InChI

InChI=1S/C24H25NO6S/c1-29-22-12-11-17(14-20(22)26)21(10-5-13-30-23(27)15-32)31-24(28)25-19-9-4-7-16-6-2-3-8-18(16)19/h2-4,6-9,11-12,14,21,26,32H,5,10,13,15H2,1H3,(H,25,28)/t21-/m1/s1