ethyl 4-[2-(2-azanyl-5-bromanyl-phenyl)carbonyloxyethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-azanyl-5-bromanyl-phenyl)carbonyloxyethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(2-amino-5-bromo-benzoyl)oxyacetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(2-amino-5-bromophenyl)-oxomethoxy]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-amino-5-bromobenzoyl)oxyacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(2-amino-5-bromo-benzoyl)oxyacetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H22BrN3O5 MolecularWeight: 428.27768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)Br)N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)Br)N

InChI

InChI=1S/C17H22BrN3O5/c1-2-25-17(24)21-7-5-12(6-8-21)20-15(22)10-26-16(23)13-9-11(18)3-4-14(13)19/h3-4,9,12H,2,5-8,10,19H2,1H3,(H,20,22)