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

Systemtic Name: [(3R,4R)-4-[(4-bromophenyl)carbamoyloxy]-3-methoxy-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate Openeye Name: [(3R,4R)-4-[(4-bromophenyl)carbamoyloxy]-4-(4-hydroxy-1-naphthyl)-3-methoxy-butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(3R,4R)-4-[(4-bromoanilino)-oxomethoxy]-4-(4-hydroxy-1-naphthalenyl)-3-methoxybutyl] ester IUPAC Name: [(3R,4R)-4-[(4-bromophenyl)carbamoyloxy]-4-(4-hydroxynaphthalen-1-yl)-3-methoxybutyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(3R,4R)-4-[(4-bromophenyl)carbamoyloxy]-4-(4-hydroxy-1-naphthyl)-3-methoxy-butyl] ester Formula: C24H24BrNO6S MolecularWeight: 534.41946

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Descriptors Computed from Structure

Canonical SMILES:

COC(CCOC(=O)CS)C(C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CO[C@H](CCOC(=O)CS)[C@@H](C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H24BrNO6S/c1-30-21(12-13-31-22(28)14-33)23(32-24(29)26-16-8-6-15(25)7-9-16)19-10-11-20(27)18-5-3-2-4-17(18)19/h2-11,21,23,27,33H,12-14H2,1H3,(H,26,29)/t21-,23-/m1/s1