1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-6-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)pyrimidine-2,4-quinone Formula: C12H19N4O2+ MolecularWeight: 251.30486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NC2=[NH+]CCCCC2

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NC2=[NH+]CCCCC2

InChI

InChI=1S/C12H18N4O2/c1-15-10(8-11(17)16(2)12(15)18)14-9-6-4-3-5-7-13-9/h8H,3-7H2,1-2H3,(H,13,14)/p+1