(E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxyphenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21NO4/c1-3-4-13-25-18-10-6-16(7-11-18)8-12-20(22)17-9-5-15(2)19(14-17)21(23)24/h5-12,14H,3-4,13H2,1-2H3/b12-8+