2-methylpropyl 2-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: 2-methylpropyl 2-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: isobutyl 2-[(4-bromo-2,6-dimethyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[(4-bromo-2,6-dimethylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[(4-bromo-2,6-dimethylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(4-bromo-2,6-dimethyl-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid isobutyl ester Formula: C18H25BrN2O3 MolecularWeight: 397.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2CCCN2C(=O)OCC(C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2CCCN2C(=O)OCC(C)C)C)Br

InChI

InChI=1S/C18H25BrN2O3/c1-11(2)10-24-18(23)21-7-5-6-15(21)17(22)20-16-12(3)8-14(19)9-13(16)4/h8-9,11,15H,5-7,10H2,1-4H3,(H,20,22)