tert-butyl N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(4-benzylpiperazine-1-carbonyl)butyl]carbamate CAS Name: N-[1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]pentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-benzylpiperazin-1-yl)-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(4-benzylpiperazine-1-carbonyl)butyl]carbamic acid tert-butyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33N3O3/c1-5-9-18(22-20(26)27-21(2,3)4)19(25)24-14-12-23(13-15-24)16-17-10-7-6-8-11-17/h6-8,10-11,18H,5,9,12-16H2,1-4H3,(H,22,26)