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

Systemtic Name: N3-(cyanomethyl)-2-(cyclohexyloxymethyl)benzene-1,3-dicarboxamide Openeye Name: N3-(cyanomethyl)-2-(cyclohexoxymethyl)benzene-1,3-dicarboxamide CAS Name: N3-(cyanomethyl)-2-(cyclohexyloxymethyl)benzene-1,3-dicarboxamide IUPAC Name: 3-N-(cyanomethyl)-2-(cyclohexyloxymethyl)benzene-1,3-dicarboxamide Traditional Name: N'-(cyanomethyl)-2-(cyclohexoxymethyl)isophthalamide Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCC2=C(C=CC=C2C(=O)NCC#N)C(=O)N

Isomeric SMILES

C1CCC(CC1)OCC2=C(C=CC=C2C(=O)NCC#N)C(=O)N

InChI

InChI=1S/C17H21N3O3/c18-9-10-20-17(22)14-8-4-7-13(16(19)21)15(14)11-23-12-5-2-1-3-6-12/h4,7-8,12H,1-3,5-6,10-11H2,(H2,19,21)(H,20,22)