4-(2-chloranyl-3-nitro-phenyl)carbonyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one

Systemtic Name: 4-(2-chloranyl-3-nitro-phenyl)carbonyl-3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Openeye Name: 4-(2-chloro-3-nitro-benzoyl)-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one CAS Name: 4-[(2-chloro-3-nitrophenyl)-oxomethyl]-3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-2-piperazinone IUPAC Name: 4-(2-chloro-3-nitrobenzoyl)-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-2-one Traditional Name: 4-(2-chloro-3-nitro-benzoyl)-3-[2-keto-2-(4-phenylpiperazino)ethyl]piperazin-2-one Formula: C23H24ClN5O5 MolecularWeight: 485.92016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H24ClN5O5/c24-21-17(7-4-8-18(21)29(33)34)23(32)28-10-9-25-22(31)19(28)15-20(30)27-13-11-26(12-14-27)16-5-2-1-3-6-16/h1-8,19H,9-15H2,(H,25,31)