ethyl 2-[bis(chloranyl)methyl]-6-nitro-1H-indole-3-carboxylate

Systemtic Name: ethyl 2-[bis(chloranyl)methyl]-6-nitro-1H-indole-3-carboxylate Openeye Name: ethyl 2-(dichloromethyl)-6-nitro-1H-indole-3-carboxylate CAS Name: 2-(dichloromethyl)-6-nitro-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(dichloromethyl)-6-nitro-1H-indole-3-carboxylate Traditional Name: 2-(dichloromethyl)-6-nitro-1H-indole-3-carboxylic acid ethyl ester Formula: C12H10Cl2N2O4 MolecularWeight: 317.1248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C1C=CC(=C2)[N+](=O)[O-])C(Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC2=C1C=CC(=C2)[N+](=O)[O-])C(Cl)Cl

InChI

InChI=1S/C12H10Cl2N2O4/c1-2-20-12(17)9-7-4-3-6(16(18)19)5-8(7)15-10(9)11(13)14/h3-5,11,15H,2H2,1H3