N-(cyanomethyl)-3-cyclohexyl-2-[2-(4-phenoxyphenyl)ethanoylamino]propanamide

Systemtic Name: N-(cyanomethyl)-3-cyclohexyl-2-[2-(4-phenoxyphenyl)ethanoylamino]propanamide Openeye Name: N-(cyanomethyl)-3-cyclohexyl-2-[[2-(4-phenoxyphenyl)acetyl]amino]propanamide CAS Name: N-(cyanomethyl)-3-cyclohexyl-2-[[1-oxo-2-(4-phenoxyphenyl)ethyl]amino]propanamide IUPAC Name: N-(cyanomethyl)-3-cyclohexyl-2-[[2-(4-phenoxyphenyl)acetyl]amino]propanamide Traditional Name: N-(cyanomethyl)-3-cyclohexyl-2-[[2-(4-phenoxyphenyl)acetyl]amino]propionamide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O3/c26-15-16-27-25(30)23(17-19-7-3-1-4-8-19)28-24(29)18-20-11-13-22(14-12-20)31-21-9-5-2-6-10-21/h2,5-6,9-14,19,23H,1,3-4,7-8,16-18H2,(H,27,30)(H,28,29)