[4-(4-fluorophenyl)-2,2-dimethyl-butyl]carbamoyl 2-cyano-4-fluoranyl-pyrrolidine-1-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-2,2-dimethyl-butyl]carbamoyl 2-cyano-4-fluoranyl-pyrrolidine-1-carboxylate Openeye Name: [4-(4-fluorophenyl)-2,2-dimethyl-butyl]carbamoyl 2-cyano-4-fluoro-pyrrolidine-1-carboxylate CAS Name: 2-cyano-4-fluoro-1-pyrrolidinecarboxylic acid [[[4-(4-fluorophenyl)-2,2-dimethylbutyl]amino]-oxomethyl] ester IUPAC Name: [4-(4-fluorophenyl)-2,2-dimethylbutyl]carbamoyl 2-cyano-4-fluoropyrrolidine-1-carboxylate Traditional Name: 2-cyano-4-fluoro-pyrrolidine-1-carboxylic acid [4-(4-fluorophenyl)-2,2-dimethyl-butyl]carbamoyl ester Formula: C19H23F2N3O3 MolecularWeight: 379.401026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=C(C=C1)F)CNC(=O)OC(=O)N2CC(CC2C#N)F

Isomeric SMILES

CC(C)(CCC1=CC=C(C=C1)F)CNC(=O)OC(=O)N2CC(CC2C#N)F

InChI

InChI=1S/C19H23F2N3O3/c1-19(2,8-7-13-3-5-14(20)6-4-13)12-23-17(25)27-18(26)24-11-15(21)9-16(24)10-22/h3-6,15-16H,7-9,11-12H2,1-2H3,(H,23,25)