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

Systemtic Name: 4-[(4S)-4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[(4S)-4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[(4S)-4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxo-1-imidazolidinyl]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[(4S)-4-(1,3-benzodioxol-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[(4S)-4-(1,3-benzodioxol-5-yl)-2,5-diketo-4-methyl-imidazolidin-1-yl]-3-keto-butyronitrile Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CN1C(=O)C(NC1=O)(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CN1C(=O)[C@](NC1=O)(C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16N4O5/c1-9(19)11(6-18)12(22)7-21-15(23)17(2,20-16(21)24)10-3-4-13-14(5-10)26-8-25-13/h3-5,11,19H,7-8H2,1-2H3,(H,20,24)/t11?,17-/m0/s1