2-[4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanenitrile Openeye Name: 2-[4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetonitrile CAS Name: 2-[4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxo-1-imidazolidinyl]acetonitrile IUPAC Name: 2-[4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetonitrile Traditional Name: 2-[4-(1,3-benzodioxol-5-yl)-2,5-diketo-4-methyl-imidazolidin-1-yl]acetonitrile Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CC#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CC#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H11N3O4/c1-13(11(17)16(5-4-14)12(18)15-13)8-2-3-9-10(6-8)20-7-19-9/h2-3,6H,5,7H2,1H3,(H,15,18)