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

Systemtic Name: (E)-1-(2,4-dichlorophenyl)-3-(3-nitro-4-piperidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2,4-dichlorophenyl)-3-[3-nitro-4-(1-piperidyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(2,4-dichlorophenyl)-3-[3-nitro-4-(1-piperidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(2,4-dichlorophenyl)-3-(3-nitro-4-piperidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(2,4-dichlorophenyl)-3-(3-nitro-4-piperidino-phenyl)prop-2-en-1-one Formula: C20H18Cl2N2O3 MolecularWeight: 405.27452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Cl2N2O3/c21-15-6-7-16(17(22)13-15)20(25)9-5-14-4-8-18(19(12-14)24(26)27)23-10-2-1-3-11-23/h4-9,12-13H,1-3,10-11H2/b9-5+