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

Systemtic Name: tert-butyl 4-[2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[2-(2-bromoanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[[2-(2-bromoanilino)-2-oxoethyl]amino]-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[[2-(2-bromoanilino)-2-oxoethyl]amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-(2-bromoanilino)-2-keto-ethyl]amino]-2-keto-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H27BrN4O4 MolecularWeight: 455.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NCC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NCC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C19H27BrN4O4/c1-19(2,3)28-18(27)24-10-8-23(9-11-24)13-17(26)21-12-16(25)22-15-7-5-4-6-14(15)20/h4-7H,8-13H2,1-3H3,(H,21,26)(H,22,25)