3-[[4-[[(4-propylcyclohexyl)amino]methyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[(4-propylcyclohexyl)amino]methyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[(4-propylcyclohexyl)amino]methyl]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[[(4-propylcyclohexyl)amino]methyl]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[[(4-propylcyclohexyl)amino]methyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[[(4-propylcyclohexyl)amino]methyl]benzoyl]amino]propionic acid Formula: C20H30N2O3 MolecularWeight: 346.4638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)NCC2=CC=C(C=C2)C(=O)NCCC(=O)O

Isomeric SMILES

CCCC1CCC(CC1)NCC2=CC=C(C=C2)C(=O)NCCC(=O)O

InChI

InChI=1S/C20H30N2O3/c1-2-3-15-6-10-18(11-7-15)22-14-16-4-8-17(9-5-16)20(25)21-13-12-19(23)24/h4-5,8-9,15,18,22H,2-3,6-7,10-14H2,1H3,(H,21,25)(H,23,24)