ethyl (Z)-3-(1-carbamimidoyl-4,4-dimethyl-2-oxidanylidene-imidazolidin-1-ium-1-yl)-2-cyano-prop-2-enoate

Systemtic Name: ethyl (Z)-3-(1-carbamimidoyl-4,4-dimethyl-2-oxidanylidene-imidazolidin-1-ium-1-yl)-2-cyano-prop-2-enoate Openeye Name: ethyl (Z)-3-(1-carbamimidoyl-4,4-dimethyl-2-oxo-imidazolidin-1-ium-1-yl)-2-cyano-prop-2-enoate CAS Name: (Z)-3-(1-carbamimidoyl-4,4-dimethyl-2-oxo-1-imidazolidin-1-iumyl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(1-carbamimidoyl-4,4-dimethyl-2-oxoimidazolidin-1-ium-1-yl)-2-cyanoprop-2-enoate Traditional Name: (Z)-3-(1-amidino-2-keto-4,4-dimethyl-imidazolidin-1-ium-1-yl)-2-cyano-acrylic acid ethyl ester Formula: C12H18N5O3+ MolecularWeight: 280.30302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C[N+]1(CC(NC1=O)(C)C)C(=N)N)C#N

Isomeric SMILES

CCOC(=O)/C(=C\[N+]1(CC(NC1=O)(C)C)C(=N)N)/C#N

InChI

InChI=1S/C12H17N5O3/c1-4-20-9(18)8(5-13)6-17(10(14)15)7-12(2,3)16-11(17)19/h6H,4,7H2,1-3H3,(H3-,14,15,16,19)/p+1/b8-6-