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

Systemtic Name: [(4R)-4-(4-methoxy-3-oxidanyl-phenyl)-3,3-dimethyl-4-(naphthalen-1-ylcarbamoyloxy)butyl] 2-sulfanylethanoate Openeye Name: [(4R)-4-(3-hydroxy-4-methoxy-phenyl)-3,3-dimethyl-4-(1-naphthylcarbamoyloxy)butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(4R)-4-(3-hydroxy-4-methoxyphenyl)-3,3-dimethyl-4-[(1-naphthalenylamino)-oxomethoxy]butyl] ester IUPAC Name: [(4R)-4-(3-hydroxy-4-methoxyphenyl)-3,3-dimethyl-4-(naphthalen-1-ylcarbamoyloxy)butyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(4R)-4-(3-hydroxy-4-methoxy-phenyl)-3,3-dimethyl-4-(1-naphthylcarbamoyloxy)butyl] ester Formula: C26H29NO6S MolecularWeight: 483.57656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29NO6S/c1-26(2,13-14-32-23(29)16-34)24(18-11-12-22(31-3)21(28)15-18)33-25(30)27-20-10-6-8-17-7-4-5-9-19(17)20/h4-12,15,24,28,34H,13-14,16H2,1-3H3,(H,27,30)/t24-/m0/s1