[(3R,4R)-3-methoxy-4-[(4-methylphenyl)carbamoyloxy]-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate

Systemtic Name: [(3R,4R)-3-methoxy-4-[(4-methylphenyl)carbamoyloxy]-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate Openeye Name: [(3R,4R)-4-(4-hydroxy-1-naphthyl)-3-methoxy-4-(p-tolylcarbamoyloxy)butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(3R,4R)-4-(4-hydroxy-1-naphthalenyl)-3-methoxy-4-[(4-methylanilino)-oxomethoxy]butyl] ester IUPAC Name: [(3R,4R)-4-(4-hydroxynaphthalen-1-yl)-3-methoxy-4-[(4-methylphenyl)carbamoyloxy]butyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(3R,4R)-4-(4-hydroxy-1-naphthyl)-3-methoxy-4-(p-tolylcarbamoyloxy)butyl] ester Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)OC(C2=CC=C(C3=CC=CC=C32)O)C(CCOC(=O)CS)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)O[C@H](C2=CC=C(C3=CC=CC=C32)O)[C@@H](CCOC(=O)CS)OC

InChI

InChI=1S/C25H27NO6S/c1-16-7-9-17(10-8-16)26-25(29)32-24(22(30-2)13-14-31-23(28)15-33)20-11-12-21(27)19-6-4-3-5-18(19)20/h3-12,22,24,27,33H,13-15H2,1-2H3,(H,26,29)/t22-,24-/m1/s1