N3-(cyanomethyl)-2-(2-cyclohexylethyl)benzene-1,3-dicarboxamide

Systemtic Name: N3-(cyanomethyl)-2-(2-cyclohexylethyl)benzene-1,3-dicarboxamide Openeye Name: N3-(cyanomethyl)-2-(2-cyclohexylethyl)benzene-1,3-dicarboxamide CAS Name: N3-(cyanomethyl)-2-(2-cyclohexylethyl)benzene-1,3-dicarboxamide IUPAC Name: 3-N-(cyanomethyl)-2-(2-cyclohexylethyl)benzene-1,3-dicarboxamide Traditional Name: N'-(cyanomethyl)-2-(2-cyclohexylethyl)isophthalamide Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=C(C=CC=C2C(=O)NCC#N)C(=O)N

Isomeric SMILES

C1CCC(CC1)CCC2=C(C=CC=C2C(=O)NCC#N)C(=O)N

InChI

InChI=1S/C18H23N3O2/c19-11-12-21-18(23)16-8-4-7-15(17(20)22)14(16)10-9-13-5-2-1-3-6-13/h4,7-8,13H,1-3,5-6,9-10,12H2,(H2,20,22)(H,21,23)