(E)-1-(4-chloranyl-3-nitro-phenyl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-chloranyl-3-nitro-phenyl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-chloro-3-nitrophenyl)-3-(3-ethoxy-2-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-3-nitrophenyl)-3-(3-ethoxy-2-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one Formula: C20H20ClNO5 MolecularWeight: 389.8295

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=CC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C/C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClNO5/c1-3-12-27-20-14(6-5-7-19(20)26-4-2)9-11-18(23)15-8-10-16(21)17(13-15)22(24)25/h5-11,13H,3-4,12H2,1-2H3/b11-9+