methyl 2,2-dimethyl-5-nitro-3H-indole-1-carboxylate

Systemtic Name: methyl 2,2-dimethyl-5-nitro-3H-indole-1-carboxylate Openeye Name: methyl 2,2-dimethyl-5-nitro-indoline-1-carboxylate CAS Name: 2,2-dimethyl-5-nitro-3H-indole-1-carboxylic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-5-nitro-3H-indole-1-carboxylate Traditional Name: 2,2-dimethyl-5-nitro-indoline-1-carboxylic acid methyl ester Formula: C12H14N2O4 MolecularWeight: 250.25056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(N1C(=O)OC)C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC2=C(N1C(=O)OC)C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H14N2O4/c1-12(2)7-8-6-9(14(16)17)4-5-10(8)13(12)11(15)18-3/h4-6H,7H2,1-3H3