(phenylmethyl) 2-(5-bromanylindol-1-yl)carbonylpyrrolidine-3-carboxylate

Systemtic Name: (phenylmethyl) 2-(5-bromanylindol-1-yl)carbonylpyrrolidine-3-carboxylate Openeye Name: benzyl 2-(5-bromoindole-1-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-[(5-bromo-1-indolyl)-oxomethyl]-3-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(5-bromoindole-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(5-bromoindole-1-carbonyl)pyrrolidine-3-carboxylic acid benzyl ester Formula: C21H19BrN2O3 MolecularWeight: 427.29116

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1C(=O)OCC2=CC=CC=C2)C(=O)N3C=CC4=C3C=CC(=C4)Br

Isomeric SMILES

C1CNC(C1C(=O)OCC2=CC=CC=C2)C(=O)N3C=CC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H19BrN2O3/c22-16-6-7-18-15(12-16)9-11-24(18)20(25)19-17(8-10-23-19)21(26)27-13-14-4-2-1-3-5-14/h1-7,9,11-12,17,19,23H,8,10,13H2