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

Systemtic Name: (E)-1-(4-chloranyl-3-nitro-phenyl)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-[3-nitro-4-(1-piperidyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-chloro-3-nitrophenyl)-3-[3-nitro-4-(1-piperidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-3-nitrophenyl)-3-(3-nitro-4-piperidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-(3-nitro-4-piperidino-phenyl)prop-2-en-1-one Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=CC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=C/C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O5/c21-16-7-6-15(13-18(16)23(26)27)20(25)9-5-14-4-8-17(19(12-14)24(28)29)22-10-2-1-3-11-22/h4-9,12-13H,1-3,10-11H2/b9-5+