tert-butyl N-[(2S)-5-(dimethylamino)-1-oxidanylidene-1-piperazin-1-yl-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-5-(dimethylamino)-1-oxidanylidene-1-piperazin-1-yl-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-4-(dimethylamino)-1-(piperazine-1-carbonyl)butyl]carbamate CAS Name: N-[(2S)-5-(dimethylamino)-1-oxo-1-(1-piperazinyl)pentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-5-(dimethylamino)-1-oxo-1-piperazin-1-ylpentan-2-yl]carbamate Traditional Name: N-[(1S)-4-(dimethylamino)-1-(piperazine-1-carbonyl)butyl]carbamic acid tert-butyl ester Formula: C16H32N4O3 MolecularWeight: 328.45028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCN(C)C)C(=O)N1CCNCC1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCN(C)C)C(=O)N1CCNCC1

InChI

InChI=1S/C16H32N4O3/c1-16(2,3)23-15(22)18-13(7-6-10-19(4)5)14(21)20-11-8-17-9-12-20/h13,17H,6-12H2,1-5H3,(H,18,22)/t13-/m0/s1