(E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-tert-butylphenyl)-3-(4-ethyl-3-nitro-phenyl)prop-2-en-1-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H23NO3/c1-5-16-8-6-15(14-19(16)22(24)25)7-13-20(23)17-9-11-18(12-10-17)21(2,3)4/h6-14H,5H2,1-4H3/b13-7+