ethyl 3-acetamido-1-nitro-3-(phenylcarbonyl)-2H-indole-2-carboxylate

Systemtic Name: ethyl 3-acetamido-1-nitro-3-(phenylcarbonyl)-2H-indole-2-carboxylate Openeye Name: ethyl 3-acetamido-3-benzoyl-1-nitro-indoline-2-carboxylate CAS Name: 3-acetamido-3-benzoyl-1-nitro-2H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetamido-3-benzoyl-1-nitro-2H-indole-2-carboxylate Traditional Name: 3-acetamido-3-benzoyl-1-nitro-indoline-2-carboxylic acid ethyl ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=CC=CC=C2N1[N+](=O)[O-])(C(=O)C3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1C(C2=CC=CC=C2N1[N+](=O)[O-])(C(=O)C3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C20H19N3O6/c1-3-29-19(26)17-20(21-13(2)24,18(25)14-9-5-4-6-10-14)15-11-7-8-12-16(15)22(17)23(27)28/h4-12,17H,3H2,1-2H3,(H,21,24)