N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[5-chloranyl-2-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[5-chloro-2-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[5-chloro-2-[4-(2-fluorobenzoyl)piperazino]phenyl]-2-morpholino-5-nitro-benzamide Formula: C28H27ClFN5O5 MolecularWeight: 567.995883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)C(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)C(=O)C5=CC=CC=C5F

InChI

InChI=1S/C28H27ClFN5O5/c29-19-5-7-26(32-9-11-34(12-10-32)28(37)21-3-1-2-4-23(21)30)24(17-19)31-27(36)22-18-20(35(38)39)6-8-25(22)33-13-15-40-16-14-33/h1-8,17-18H,9-16H2,(H,31,36)