tert-butyl (2R)-2-[[[2-azanyl-4-(diethylcarbamoyl)phenyl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[[[2-azanyl-4-(diethylcarbamoyl)phenyl]amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[[2-amino-4-(diethylcarbamoyl)anilino]methyl]piperidine-1-carboxylate CAS Name: (2R)-2-[[2-amino-4-[diethylamino(oxo)methyl]anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[[2-amino-4-(diethylcarbamoyl)anilino]methyl]piperidine-1-carboxylate Traditional Name: (2R)-2-[[2-amino-4-(diethylcarbamoyl)anilino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H36N4O3 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=C(C=C1)NCC2CCCCN2C(=O)OC(C)(C)C)N

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=C(C=C1)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)N

InChI

InChI=1S/C22H36N4O3/c1-6-25(7-2)20(27)16-11-12-19(18(23)14-16)24-15-17-10-8-9-13-26(17)21(28)29-22(3,4)5/h11-12,14,17,24H,6-10,13,15,23H2,1-5H3/t17-/m1/s1