phenethyl 2-(5-nitro-1H-indol-3-yl)-2-oxidanylidene-ethanoate

Systemtic Name: phenethyl 2-(5-nitro-1H-indol-3-yl)-2-oxidanylidene-ethanoate Openeye Name: phenethyl 2-(5-nitro-1H-indol-3-yl)-2-oxo-acetate CAS Name: 2-(5-nitro-1H-indol-3-yl)-2-oxoacetic acid phenethyl ester IUPAC Name: phenethyl 2-(5-nitro-1H-indol-3-yl)-2-oxoacetate Traditional Name: 2-keto-2-(5-nitro-1H-indol-3-yl)acetic acid phenethyl ester Formula: C18H14N2O5 MolecularWeight: 338.31416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)C(=O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)C(=O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5/c21-17(18(22)25-9-8-12-4-2-1-3-5-12)15-11-19-16-7-6-13(20(23)24)10-14(15)16/h1-7,10-11,19H,8-9H2