2-[2-[4-[4-(4-azanylcyclohexyl)oxyphenoxy]phenyl]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[4-[4-(4-azanylcyclohexyl)oxyphenoxy]phenyl]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[4-[4-(4-aminocyclohexoxy)phenoxy]phenyl]acetyl]amino]benzoic acid CAS Name: 2-[[2-[4-[4-(4-aminocyclohexyl)oxyphenoxy]phenyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-[4-[4-(4-aminocyclohexyl)oxyphenoxy]phenyl]acetyl]amino]benzoic acid Traditional Name: 2-[[2-[4-[4-(4-aminocyclohexoxy)phenoxy]phenyl]acetyl]amino]benzoic acid Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)CC(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CC(CCC1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)CC(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H28N2O5/c28-19-7-11-21(12-8-19)34-23-15-13-22(14-16-23)33-20-9-5-18(6-10-20)17-26(30)29-25-4-2-1-3-24(25)27(31)32/h1-6,9-10,13-16,19,21H,7-8,11-12,17,28H2,(H,29,30)(H,31,32)