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

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzoyl-1-piperidyl)-3-(4-chloro-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-benzoyl-1-piperidinyl)-3-(4-chloro-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-benzoylpiperidin-1-yl)-3-(4-chloro-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoylpiperidino)-3-(4-chloro-3-nitro-phenyl)prop-2-en-1-one Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H19ClN2O4/c22-18-8-6-15(14-19(18)24(27)28)7-9-20(25)23-12-10-17(11-13-23)21(26)16-4-2-1-3-5-16/h1-9,14,17H,10-13H2/b9-7+