(1R,2S)-2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[2-[2-(1-naphthyl)propanoylamino]phenyl]methyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[2-[2-(1-naphthyl)propanoylamino]benzyl]cyclohexanecarboxylic acid Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CC4CCCCC4C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3C[C@@H]4CCCC[C@H]4C(=O)O

InChI

InChI=1S/C27H29NO3/c1-18(22-15-8-12-19-9-2-5-13-23(19)22)26(29)28-25-16-7-4-11-21(25)17-20-10-3-6-14-24(20)27(30)31/h2,4-5,7-9,11-13,15-16,18,20,24H,3,6,10,14,17H2,1H3,(H,28,29)(H,30,31)/t18?,20-,24+/m0/s1