3-acetamido-N2-(cyanomethyl)-4-cyclohexyl-benzene-1,2-dicarboxamide

Systemtic Name: 3-acetamido-N2-(cyanomethyl)-4-cyclohexyl-benzene-1,2-dicarboxamide Openeye Name: 3-acetamido-N2-(cyanomethyl)-4-cyclohexyl-phthalamide CAS Name: 3-acetamido-N2-(cyanomethyl)-4-cyclohexylbenzene-1,2-dicarboxamide IUPAC Name: 3-acetamido-2-N-(cyanomethyl)-4-cyclohexylbenzene-1,2-dicarboxamide Traditional Name: 3-acetamido-N'-(cyanomethyl)-4-cyclohexyl-phthalamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1C(=O)NCC#N)C(=O)N)C2CCCCC2

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1C(=O)NCC#N)C(=O)N)C2CCCCC2

InChI

InChI=1S/C18H22N4O3/c1-11(23)22-16-13(12-5-3-2-4-6-12)7-8-14(17(20)24)15(16)18(25)21-10-9-19/h7-8,12H,2-6,10H2,1H3,(H2,20,24)(H,21,25)(H,22,23)