4-[[2-(4-cyclohexylphenoxy)ethanoylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(4-cyclohexylphenoxy)ethanoylamino]methyl]benzoic acid Openeye Name: 4-[[[2-(4-cyclohexylphenoxy)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[[2-(4-cyclohexylphenoxy)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[2-(4-cyclohexylphenoxy)acetyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-(4-cyclohexylphenoxy)acetyl]amino]methyl]benzoic acid Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H25NO4/c24-21(23-14-16-6-8-19(9-7-16)22(25)26)15-27-20-12-10-18(11-13-20)17-4-2-1-3-5-17/h6-13,17H,1-5,14-15H2,(H,23,24)(H,25,26)