ethyl 1-[(4-bromanyl-2-methyl-phenyl)carbamoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-bromanyl-2-methyl-phenyl)carbamoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(4-bromo-2-methyl-phenyl)carbamoyl]piperidine-3-carboxylate CAS Name: 1-[(4-bromo-2-methylanilino)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-bromo-2-methylphenyl)carbamoyl]piperidine-3-carboxylate Traditional Name: 1-[(4-bromo-2-methyl-phenyl)carbamoyl]nipecotic acid ethyl ester Formula: C16H21BrN2O3 MolecularWeight: 369.25354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C16H21BrN2O3/c1-3-22-15(20)12-5-4-8-19(10-12)16(21)18-14-7-6-13(17)9-11(14)2/h6-7,9,12H,3-5,8,10H2,1-2H3,(H,18,21)