N-(cyanomethyl)-1-(3-phenylpropanoylamino)cyclohexane-1-carboxamide

Systemtic Name: N-(cyanomethyl)-1-(3-phenylpropanoylamino)cyclohexane-1-carboxamide Openeye Name: N-(cyanomethyl)-1-(3-phenylpropanoylamino)cyclohexanecarboxamide CAS Name: N-(cyanomethyl)-1-[(1-oxo-3-phenylpropyl)amino]-1-cyclohexanecarboxamide IUPAC Name: N-(cyanomethyl)-1-(3-phenylpropanoylamino)cyclohexane-1-carboxamide Traditional Name: N-(cyanomethyl)-1-(hydrocinnamoylamino)cyclohexanecarboxamide Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC#N)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC#N)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O2/c19-13-14-20-17(23)18(11-5-2-6-12-18)21-16(22)10-9-15-7-3-1-4-8-15/h1,3-4,7-8H,2,5-6,9-12,14H2,(H,20,23)(H,21,22)