(4-nitrophenyl) 2-methyl-5-nitro-indole-1-carboxylate

Systemtic Name: (4-nitrophenyl) 2-methyl-5-nitro-indole-1-carboxylate Openeye Name: (4-nitrophenyl) 2-methyl-5-nitro-indole-1-carboxylate CAS Name: 2-methyl-5-nitro-1-indolecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-methyl-5-nitroindole-1-carboxylate Traditional Name: 2-methyl-5-nitro-indole-1-carboxylic acid (4-nitrophenyl) ester Formula: C16H11N3O6 MolecularWeight: 341.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(N1C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O6/c1-10-8-11-9-13(19(23)24)4-7-15(11)17(10)16(20)25-14-5-2-12(3-6-14)18(21)22/h2-9H,1H3