ethyl 2-pyrrolo[1,2-c]pyrimidin-2-ium-2-ylethanoate

Systemtic Name: ethyl 2-pyrrolo[1,2-c]pyrimidin-2-ium-2-ylethanoate Openeye Name: ethyl 2-pyrrolo[1,2-c]pyrimidin-2-ium-2-ylacetate CAS Name: 2-(2-pyrrolo[1,2-c]pyrimidin-2-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-pyrrolo[1,2-c]pyrimidin-2-ium-2-ylacetate Traditional Name: 2-pyrrolo[1,2-c]pyrimidin-2-ium-2-ylacetic acid ethyl ester Formula: C11H13N2O2+ MolecularWeight: 205.23312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CN2C=CC=C2C=C1

Isomeric SMILES

CCOC(=O)C[N+]1=CN2C=CC=C2C=C1

InChI

InChI=1S/C11H13N2O2/c1-2-15-11(14)8-12-7-5-10-4-3-6-13(10)9-12/h3-7,9H,2,8H2,1H3/q+1