(E)-1-(4-chloranyl-3-nitro-phenyl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-chloranyl-3-nitro-phenyl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-[2-(2-pyridylmethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-chloro-3-nitrophenyl)-3-[2-(2-pyridinylmethoxy)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-3-nitrophenyl)-3-[2-(pyridin-2-ylmethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-[2-(2-pyridylmethoxy)phenyl]prop-2-en-1-one Formula: C21H15ClN2O4 MolecularWeight: 394.8078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OCC3=CC=CC=N3

InChI

InChI=1S/C21H15ClN2O4/c22-18-10-8-16(13-19(18)24(26)27)20(25)11-9-15-5-1-2-7-21(15)28-14-17-6-3-4-12-23-17/h1-13H,14H2/b11-9+