tert-butyl 2-[4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[4-[2-(benzylamino)-2-oxo-ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate CAS Name: 2-[oxo-[4-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-piperazinyl]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[2-(benzylamino)-2-oxoethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Traditional Name: 2-[4-[2-(benzylamino)-2-keto-ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H34N4O4 MolecularWeight: 430.54046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H34N4O4/c1-23(2,3)31-22(30)27-11-7-10-19(27)21(29)26-14-12-25(13-15-26)17-20(28)24-16-18-8-5-4-6-9-18/h4-6,8-9,19H,7,10-17H2,1-3H3,(H,24,28)