4-(4-nitrophenyl)butyl N-[(1,4-dimethylpiperazin-2-yl)carbonylamino]carbamate

Systemtic Name: 4-(4-nitrophenyl)butyl N-[(1,4-dimethylpiperazin-2-yl)carbonylamino]carbamate Openeye Name: 4-(4-nitrophenyl)butyl N-[(1,4-dimethylpiperazine-2-carbonyl)amino]carbamate CAS Name: N-[[(1,4-dimethyl-2-piperazinyl)-oxomethyl]amino]carbamic acid 4-(4-nitrophenyl)butyl ester IUPAC Name: 4-(4-nitrophenyl)butyl N-[(1,4-dimethylpiperazine-2-carbonyl)amino]carbamate Traditional Name: N-[(1,4-dimethylpiperazine-2-carbonyl)amino]carbamic acid 4-(4-nitrophenyl)butyl ester Formula: C18H27N5O5 MolecularWeight: 393.43748

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C(=O)NNC(=O)OCCCCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CN1CCN(C(C1)C(=O)NNC(=O)OCCCCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H27N5O5/c1-21-10-11-22(2)16(13-21)17(24)19-20-18(25)28-12-4-3-5-14-6-8-15(9-7-14)23(26)27/h6-9,16H,3-5,10-13H2,1-2H3,(H,19,24)(H,20,25)