[(1S,2S)-4-oxidanyl-1-(4-oxidanylnaphthalen-1-yl)-2-phenoxy-butyl] N-(4-bromophenyl)carbamate

Systemtic Name: [(1S,2S)-4-oxidanyl-1-(4-oxidanylnaphthalen-1-yl)-2-phenoxy-butyl] N-(4-bromophenyl)carbamate Openeye Name: [(1S,2S)-4-hydroxy-1-(4-hydroxy-1-naphthyl)-2-phenoxy-butyl] N-(4-bromophenyl)carbamate CAS Name: N-(4-bromophenyl)carbamic acid [(1S,2S)-4-hydroxy-1-(4-hydroxy-1-naphthalenyl)-2-phenoxybutyl] ester IUPAC Name: [(1S,2S)-4-hydroxy-1-(4-hydroxynaphthalen-1-yl)-2-phenoxybutyl] N-(4-bromophenyl)carbamate Traditional Name: N-(4-bromophenyl)carbamic acid [(1S,2S)-4-hydroxy-1-(4-hydroxy-1-naphthyl)-2-phenoxy-butyl] ester Formula: C27H24BrNO5 MolecularWeight: 522.38716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CCO)C(C2=CC=C(C3=CC=CC=C32)O)OC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)O[C@@H](CCO)[C@H](C2=CC=C(C3=CC=CC=C32)O)OC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C27H24BrNO5/c28-18-10-12-19(13-11-18)29-27(32)34-26(25(16-17-30)33-20-6-2-1-3-7-20)23-14-15-24(31)22-9-5-4-8-21(22)23/h1-15,25-26,30-31H,16-17H2,(H,29,32)/t25-,26-/m0/s1