(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-1-propan-2-yl-piperidin-4-one

Systemtic Name: (3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-1-propan-2-yl-piperidin-4-one Openeye Name: (3E,5E)-1-isopropyl-3,5-bis[(4-nitrophenyl)methylene]piperidin-4-one CAS Name: (3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-1-propan-2-yl-4-piperidinone IUPAC Name: (3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-1-propan-2-ylpiperidin-4-one Traditional Name: (3E,5E)-1-isopropyl-3,5-bis(4-nitrobenzylidene)-4-piperidone Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])C1

Isomeric SMILES

CC(N1C/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C1)C

InChI

InChI=1S/C22H21N3O5/c1-15(2)23-13-18(11-16-3-7-20(8-4-16)24(27)28)22(26)19(14-23)12-17-5-9-21(10-6-17)25(29)30/h3-12,15H,13-14H2,1-2H3/b18-11+,19-12+