[[2-(2-methylpropyl)-3-(propan-2-yloxycarbamoyl)hexanoyl]amino] 3-phenylpropanoate

Systemtic Name: [[2-(2-methylpropyl)-3-(propan-2-yloxycarbamoyl)hexanoyl]amino] 3-phenylpropanoate Openeye Name: [[2-isobutyl-3-(isopropoxycarbamoyl)hexanoyl]amino] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [[2-(2-methylpropyl)-1-oxo-3-[oxo-(propan-2-yloxyamino)methyl]hexyl]amino] ester IUPAC Name: [[2-(2-methylpropyl)-3-(propan-2-yloxycarbamoyl)hexanoyl]amino] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [[2-isobutyl-3-(isopropoxycarbamoyl)hexanoyl]amino] ester Formula: C23H36N2O5 MolecularWeight: 420.54234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)NOC(=O)CCC1=CC=CC=C1)C(=O)NOC(C)C

Isomeric SMILES

CCCC(C(CC(C)C)C(=O)NOC(=O)CCC1=CC=CC=C1)C(=O)NOC(C)C

InChI

InChI=1S/C23H36N2O5/c1-6-10-19(22(27)24-29-17(4)5)20(15-16(2)3)23(28)25-30-21(26)14-13-18-11-8-7-9-12-18/h7-9,11-12,16-17,19-20H,6,10,13-15H2,1-5H3,(H,24,27)(H,25,28)