ethyl 4-[(5-bromanyl-2-oxidanyl-phenyl)methyl-(dimethylcarbamoyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(5-bromanyl-2-oxidanyl-phenyl)methyl-(dimethylcarbamoyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(5-bromo-2-hydroxy-phenyl)methyl-(dimethylcarbamoyl)amino]piperidine-1-carboxylate CAS Name: 4-[(5-bromo-2-hydroxyphenyl)methyl-[dimethylamino(oxo)methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromo-2-hydroxyphenyl)methyl-(dimethylcarbamoyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(5-bromo-2-hydroxy-benzyl)-(dimethylcarbamoyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H26BrN3O4 MolecularWeight: 428.32074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CC2=C(C=CC(=C2)Br)O)C(=O)N(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CC2=C(C=CC(=C2)Br)O)C(=O)N(C)C

InChI

InChI=1S/C18H26BrN3O4/c1-4-26-18(25)21-9-7-15(8-10-21)22(17(24)20(2)3)12-13-11-14(19)5-6-16(13)23/h5-6,11,15,23H,4,7-10,12H2,1-3H3