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

Systemtic Name: [(3R,4R)-4-[(4-ethanoylphenyl)carbamoyloxy]-3-methoxy-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate Openeye Name: [(3R,4R)-4-[(4-acetylphenyl)carbamoyloxy]-4-(4-hydroxy-1-naphthyl)-3-methoxy-butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(3R,4R)-4-[(4-acetylanilino)-oxomethoxy]-4-(4-hydroxy-1-naphthalenyl)-3-methoxybutyl] ester IUPAC Name: [(3R,4R)-4-[(4-acetylphenyl)carbamoyloxy]-4-(4-hydroxynaphthalen-1-yl)-3-methoxybutyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(3R,4R)-4-[(4-acetylphenyl)carbamoyloxy]-4-(4-hydroxy-1-naphthyl)-3-methoxy-butyl] ester Formula: C26H27NO7S MolecularWeight: 497.56008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)C1=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/C26H27NO7S/c1-16(28)17-7-9-18(10-8-17)27-26(31)34-25(23(32-2)13-14-33-24(30)15-35)21-11-12-22(29)20-6-4-3-5-19(20)21/h3-12,23,25,29,35H,13-15H2,1-2H3,(H,27,31)/t23-,25-/m1/s1