(3R,5R)-1-[[4-[2-(naphthalen-1-ylmethylcarbamoyl)phenyl]phenyl]methoxy]-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid

Systemtic Name: (3R,5R)-1-[[4-[2-(naphthalen-1-ylmethylcarbamoyl)phenyl]phenyl]methoxy]-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid Openeye Name: (3R,5R)-3,4,5-trihydroxy-1-[[4-[2-(1-naphthylmethylcarbamoyl)phenyl]phenyl]methoxy]cyclohexanecarboxylic acid CAS Name: (3R,5R)-3,4,5-trihydroxy-1-[[4-[2-[(1-naphthalenylmethylamino)-oxomethyl]phenyl]phenyl]methoxy]-1-cyclohexanecarboxylic acid IUPAC Name: (3R,5R)-3,4,5-trihydroxy-1-[[4-[2-(naphthalen-1-ylmethylcarbamoyl)phenyl]phenyl]methoxy]cyclohexane-1-carboxylic acid Traditional Name: (3R,5R)-3,4,5-trihydroxy-1-[4-[2-(1-naphthylmethylcarbamoyl)phenyl]benzyl]oxy-cyclohexanecarboxylic acid Formula: C32H31NO7 MolecularWeight: 541.59104

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(CC1(C(=O)O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)NCC4=CC=CC5=CC=CC=C54)O)O)O

Isomeric SMILES

C1[C@H](C([C@@H](CC1(C(=O)O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)NCC4=CC=CC5=CC=CC=C54)O)O)O

InChI

InChI=1S/C32H31NO7/c34-27-16-32(31(38)39,17-28(35)29(27)36)40-19-20-12-14-22(15-13-20)25-10-3-4-11-26(25)30(37)33-18-23-8-5-7-21-6-1-2-9-24(21)23/h1-15,27-29,34-36H,16-19H2,(H,33,37)(H,38,39)/t27-,28-,29?,32?/m1/s1