ethyl 3-azanyl-4-nitro-2-(phenylcarbonyl)-6-(trifluoromethyl)indole-1-carboxylate

Systemtic Name: ethyl 3-azanyl-4-nitro-2-(phenylcarbonyl)-6-(trifluoromethyl)indole-1-carboxylate Openeye Name: ethyl 3-amino-2-benzoyl-4-nitro-6-(trifluoromethyl)indole-1-carboxylate CAS Name: 3-amino-2-benzoyl-4-nitro-6-(trifluoromethyl)-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-2-benzoyl-4-nitro-6-(trifluoromethyl)indole-1-carboxylate Traditional Name: 3-amino-2-benzoyl-4-nitro-6-(trifluoromethyl)indole-1-carboxylic acid ethyl ester Formula: C19H14F3N3O5 MolecularWeight: 421.32677

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C(=CC(=C2)C(F)(F)F)[N+](=O)[O-])C(=C1C(=O)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)N1C2=C(C(=CC(=C2)C(F)(F)F)[N+](=O)[O-])C(=C1C(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C19H14F3N3O5/c1-2-30-18(27)24-12-8-11(19(20,21)22)9-13(25(28)29)14(12)15(23)16(24)17(26)10-6-4-3-5-7-10/h3-9H,2,23H2,1H3