2-(2-pentan-3-yl-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl)ethanenitrile

Systemtic Name: 2-(2-pentan-3-yl-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl)ethanenitrile Openeye Name: 2-[2-(1-ethylpropyl)-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl]acetonitrile CAS Name: 2-(2-pentan-3-yl-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl)acetonitrile IUPAC Name: 2-(2-pentan-3-yl-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl)acetonitrile Traditional Name: 2-[2-(1-ethylpropyl)-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl]acetonitrile Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NC2=CC3=C(C=C2N1CC#N)OCCO3

Isomeric SMILES

CCC(CC)C1=NC2=CC3=C(C=C2N1CC#N)OCCO3

InChI

InChI=1S/C16H19N3O2/c1-3-11(4-2)16-18-12-9-14-15(21-8-7-20-14)10-13(12)19(16)6-5-17/h9-11H,3-4,6-8H2,1-2H3