[2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanylbenzoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C23H16BrNO3 MolecularWeight: 434.28204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CNC3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrNO3/c24-17-12-10-16(11-13-17)23(27)28-22(15-6-2-1-3-7-15)21(26)19-14-25-20-9-5-4-8-18(19)20/h1-14,22,25H