(E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitrophenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitrophenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-tert-butylphenyl)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-en-1-one Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O3/c1-21(2,3)17-10-8-16(9-11-17)20(24)13-7-15-6-12-18(22(4)5)19(14-15)23(25)26/h6-14H,1-5H3/b13-7+