tert-butyl 4-[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(cyanomethyl)anilino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-(cyanomethyl)anilino]-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(cyanomethyl)anilino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-(cyanomethyl)anilino]-2-keto-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C19H26N4O3/c1-19(2,3)26-18(25)23-12-10-22(11-13-23)14-17(24)21-16-6-4-15(5-7-16)8-9-20/h4-7H,8,10-14H2,1-3H3,(H,21,24)