tert-butyl 4-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-(4-pyrrolidinoanilino)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C21H32N4O3/c1-21(2,3)28-20(27)25-14-12-23(13-15-25)16-19(26)22-17-6-8-18(9-7-17)24-10-4-5-11-24/h6-9H,4-5,10-16H2,1-3H3,(H,22,26)