[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H17BrN2O3/c14-9-6-11(15-7-9)13(18)19-8-12(17)16-10-4-2-1-3-5-10/h6-7,10,15H,1-5,8H2,(H,16,17)