ethyl 5-(3,5-dinitrophenyl)carbonyloxy-2-methyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 5-(3,5-dinitrophenyl)carbonyloxy-2-methyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 5-(3,5-dinitrobenzoyl)oxy-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-[(3,5-dinitrophenyl)-oxomethoxy]-2-methyl-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,5-dinitrobenzoyl)oxy-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-(3,5-dinitrobenzoyl)oxy-2-methyl-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H19N3O8 MolecularWeight: 489.43366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4)C

InChI

InChI=1S/C25H19N3O8/c1-3-35-25(30)23-15(2)26(17-7-5-4-6-8-17)22-10-9-20(14-21(22)23)36-24(29)16-11-18(27(31)32)13-19(12-16)28(33)34/h4-14H,3H2,1-2H3