tert-butyl 4-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[3-[dimethylamino(oxo)methyl]phenyl]methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(dimethylcarbamoyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(dimethylcarbamoyl)benzyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C

InChI

InChI=1S/C21H31N3O4/c1-21(2,3)28-20(27)24-11-9-16(10-12-24)18(25)22-14-15-7-6-8-17(13-15)19(26)23(4)5/h6-8,13,16H,9-12,14H2,1-5H3,(H,22,25)