1-(3-nitrophenyl)ethyl 5-bromanyl-1H-indole-3-carboxylate

Systemtic Name: 1-(3-nitrophenyl)ethyl 5-bromanyl-1H-indole-3-carboxylate Openeye Name: 1-(3-nitrophenyl)ethyl 5-bromo-1H-indole-3-carboxylate CAS Name: 5-bromo-1H-indole-3-carboxylic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 5-bromo-1H-indole-3-carboxylate Traditional Name: 5-bromo-1H-indole-3-carboxylic acid 1-(3-nitrophenyl)ethyl ester Formula: C17H13BrN2O4 MolecularWeight: 389.20012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C17H13BrN2O4/c1-10(11-3-2-4-13(7-11)20(22)23)24-17(21)15-9-19-16-6-5-12(18)8-14(15)16/h2-10,19H,1H3