4-[2-(cyclohexylcarbonylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(cyclohexylcarbonylamino)ethyl]benzoic acid Openeye Name: 4-[2-(cyclohexanecarbonylamino)ethyl]benzoic acid CAS Name: 4-[2-[[cyclohexyl(oxo)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-(cyclohexanecarbonylamino)ethyl]benzoic acid Traditional Name: 4-[2-(cyclohexanecarbonylamino)ethyl]benzoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H21NO3/c18-15(13-4-2-1-3-5-13)17-11-10-12-6-8-14(9-7-12)16(19)20/h6-9,13H,1-5,10-11H2,(H,17,18)(H,19,20)