tert-butyl 4-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[3-[oxo(1-pyrrolidinyl)methyl]anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C22H31N3O4/c1-22(2,3)29-21(28)25-13-9-16(10-14-25)19(26)23-18-8-6-7-17(15-18)20(27)24-11-4-5-12-24/h6-8,15-16H,4-5,9-14H2,1-3H3,(H,23,26)