methyl (E)-3-[2-(2-pyrrolo[1,2-a]pyrazin-2-ium-2-ylethanoyloxy)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[2-(2-pyrrolo[1,2-a]pyrazin-2-ium-2-ylethanoyloxy)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[2-(2-pyrrolo[1,2-a]pyrazin-2-ium-2-ylacetyl)oxyphenyl]prop-2-enoate CAS Name: (E)-3-[2-[1-oxo-2-(2-pyrrolo[1,2-a]pyrazin-2-iumyl)ethoxy]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[2-(2-pyrrolo[1,2-a]pyrazin-2-ium-2-ylacetyl)oxyphenyl]prop-2-enoate Traditional Name: (E)-3-[2-(2-pyrrolo[1,2-a]pyrazin-2-ium-2-ylacetyl)oxyphenyl]acrylic acid methyl ester Formula: C19H17N2O4+ MolecularWeight: 337.34928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=CC=C1OC(=O)C[N+]2=CC3=CC=CN3C=C2

Isomeric SMILES

COC(=O)/C=C/C1=CC=CC=C1OC(=O)C[N+]2=CC3=CC=CN3C=C2

InChI

InChI=1S/C19H17N2O4/c1-24-18(22)9-8-15-5-2-3-7-17(15)25-19(23)14-20-11-12-21-10-4-6-16(21)13-20/h2-13H,14H2,1H3/q+1/b9-8+