1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]pyrimidine-2,4-dione

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]pyrimidine-2,4-dione Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]pyrimidine-2,4-dione CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]pyrimidine-2,4-dione Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]pyrimidine-2,4-quinone Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C=CC(=O)NC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C=CC(=O)NC2=O

InChI

InChI=1S/C12H17N3O3/c16-10-5-8-15(12(18)13-10)9-11(17)14-6-3-1-2-4-7-14/h5,8H,1-4,6-7,9H2,(H,13,16,18)