2-(1,3-benzodioxol-5-yl)-2-morpholin-4-yl-pent-4-ynenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-morpholin-4-yl-pent-4-ynenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-morpholino-pent-4-ynenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(4-morpholinyl)-4-pentynenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ylpent-4-ynenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-morpholino-pent-4-ynenitrile Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(C#N)(C1=CC2=C(C=C1)OCO2)N3CCOCC3

Isomeric SMILES

C#CCC(C#N)(C1=CC2=C(C=C1)OCO2)N3CCOCC3

InChI

InChI=1S/C16H16N2O3/c1-2-5-16(11-17,18-6-8-19-9-7-18)13-3-4-14-15(10-13)21-12-20-14/h1,3-4,10H,5-9,12H2