[(3S,4S)-3-methoxy-4-(4-oxidanylnaphthalen-1-yl)-4-(phenylcarbamoyloxy)butyl] 2-sulfanylethanoate

Systemtic Name: [(3S,4S)-3-methoxy-4-(4-oxidanylnaphthalen-1-yl)-4-(phenylcarbamoyloxy)butyl] 2-sulfanylethanoate Openeye Name: [(3S,4S)-4-(4-hydroxy-1-naphthyl)-3-methoxy-4-(phenylcarbamoyloxy)butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(3S,4S)-4-[anilino(oxo)methoxy]-4-(4-hydroxy-1-naphthalenyl)-3-methoxybutyl] ester IUPAC Name: [(3S,4S)-4-(4-hydroxynaphthalen-1-yl)-3-methoxy-4-(phenylcarbamoyloxy)butyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(3S,4S)-4-(4-hydroxy-1-naphthyl)-3-methoxy-4-(phenylcarbamoyloxy)butyl] ester Formula: C24H25NO6S MolecularWeight: 455.5234

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO6S/c1-29-21(13-14-30-22(27)15-32)23(31-24(28)25-16-7-3-2-4-8-16)19-11-12-20(26)18-10-6-5-9-17(18)19/h2-12,21,23,26,32H,13-15H2,1H3,(H,25,28)/t21-,23-/m0/s1