[2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(5-nitronaphthalen-1-yl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(5-nitro-1-naphthyl)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-(5-nitro-1-naphthalenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-nitronaphthalen-1-yl)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-2-(5-nitro-1-naphthyl)ethyl] ester Formula: C17H11N3O5 MolecularWeight: 337.28634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)C(=O)COC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)C(=O)COC(=O)C3=NC=CN=C3

InChI

InChI=1S/C17H11N3O5/c21-16(10-25-17(22)14-9-18-7-8-19-14)13-5-1-4-12-11(13)3-2-6-15(12)20(23)24/h1-9H,10H2