(E)-azanylidene-[1-ethoxy-1,3-bis(oxidanylidene)-4-thiocyanato-butan-2-ylidene]azanium

Systemtic Name: (E)-azanylidene-[1-ethoxy-1,3-bis(oxidanylidene)-4-thiocyanato-butan-2-ylidene]azanium Openeye Name: (E)-(1-ethoxycarbonyl-2-oxo-3-thiocyanato-propylidene)-imino-ammonium CAS Name: (E)-(1-ethoxy-1,3-dioxo-4-thiocyanatobutan-2-ylidene)-iminoammonium IUPAC Name: (E)-(1-ethoxy-1,3-dioxo-4-thiocyanatobutan-2-ylidene)-iminoazanium Traditional Name: (E)-(1-carbethoxy-2-keto-3-thiocyanato-propylidene)-imino-ammonium Formula: C7H8N3O3S+ MolecularWeight: 214.22172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=[N+]=N)C(=O)CSC#N

Isomeric SMILES

CCOC(=O)C(=[N+]=N)C(=O)CSC#N

InChI

InChI=1S/C7H8N3O3S/c1-2-13-7(12)6(10-9)5(11)3-14-4-8/h9H,2-3H2,1H3/q+1