ethyl 1-(1,3-benzodioxol-5-yl)-6-nitro-indole-2-carboxylate

Systemtic Name: ethyl 1-(1,3-benzodioxol-5-yl)-6-nitro-indole-2-carboxylate Openeye Name: ethyl 1-(1,3-benzodioxol-5-yl)-6-nitro-indole-2-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-6-nitro-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,3-benzodioxol-5-yl)-6-nitroindole-2-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-6-nitro-indole-2-carboxylic acid ethyl ester Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1C3=CC4=C(C=C3)OCO4)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1C3=CC4=C(C=C3)OCO4)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O6/c1-2-24-18(21)15-7-11-3-4-13(20(22)23)8-14(11)19(15)12-5-6-16-17(9-12)26-10-25-16/h3-9H,2,10H2,1H3