ethyl 3-[2,5-bis(oxidanylidene)-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl]propanoate

Systemtic Name: ethyl 3-[2,5-bis(oxidanylidene)-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl]propanoate Openeye Name: ethyl 3-(2,5-dioxo-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl)propanoate CAS Name: 3-(2,5-dioxo-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2,5-dioxo-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazol-4-yl)propanoate Traditional Name: 3-(2,5-diketo-3,3a,6,6a-tetrahydro-1H-imidaz[4,5-d]imidazol-4-yl)propionic acid ethyl ester Formula: C9H14N4O4 MolecularWeight: 242.23186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2C(NC(=O)N2)NC1=O

Isomeric SMILES

CCOC(=O)CCN1C2C(NC(=O)N2)NC1=O

InChI

InChI=1S/C9H14N4O4/c1-2-17-5(14)3-4-13-7-6(11-9(13)16)10-8(15)12-7/h6-7H,2-4H2,1H3,(H,11,16)(H2,10,12,15)