[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl] 1-(2-furylmethylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[(2-furanylmethylamino)-oxomethyl]-4-piperidinecarboxylic acid [2-(2-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl] 1-(furan-2-ylmethylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(2-furfurylcarbamoyl)isonipecotic acid [2-(2-bromoanilino)-2-keto-ethyl] ester Formula: C20H22BrN3O5 MolecularWeight: 464.30978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC=C2Br)C(=O)NCC3=CC=CO3

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC=C2Br)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H22BrN3O5/c21-16-5-1-2-6-17(16)23-18(25)13-29-19(26)14-7-9-24(10-8-14)20(27)22-12-15-4-3-11-28-15/h1-6,11,14H,7-10,12-13H2,(H,22,27)(H,23,25)