(E)-3-(4-chloranyl-3-nitro-phenyl)-1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-1-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-1-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-1-[4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-1-[4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-1-[4-(4-nitro-3-piperidino-phenyl)piperazino]prop-2-en-1-one Formula: C24H26ClN5O5 MolecularWeight: 499.94674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)/C=C/C4=CC(=C(C=C4)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H26ClN5O5/c25-20-7-4-18(16-22(20)30(34)35)5-9-24(31)28-14-12-26(13-15-28)19-6-8-21(29(32)33)23(17-19)27-10-2-1-3-11-27/h4-9,16-17H,1-3,10-15H2/b9-5+