4-azanyl-1-(2,2-dimethylpropanoyl)-1-phenylmethoxy-pyrimidin-1-ium-2-one

Systemtic Name: 4-azanyl-1-(2,2-dimethylpropanoyl)-1-phenylmethoxy-pyrimidin-1-ium-2-one Openeye Name: 4-amino-1-benzyloxy-1-(2,2-dimethylpropanoyl)pyrimidin-1-ium-2-one CAS Name: 4-amino-1-(2,2-dimethyl-1-oxopropyl)-1-phenylmethoxy-2-pyrimidin-1-iumone IUPAC Name: 4-amino-1-(2,2-dimethylpropanoyl)-1-phenylmethoxypyrimidin-1-ium-2-one Traditional Name: 4-amino-1-benzoxy-1-pivaloyl-pyrimidin-1-ium-2-one Formula: C16H20N3O3+ MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)[N+]1(C=CC(=NC1=O)N)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)[N+]1(C=CC(=NC1=O)N)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O3/c1-16(2,3)14(20)19(10-9-13(17)18-15(19)21)22-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3,(H-,17,18,21)/p+1