(E)-1-(4-dimethylaminophenyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-dimethylaminophenyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-dimethylaminophenyl)-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-dimethylaminophenyl)-3-(3-nitro-4-propan-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-dimethylaminophenyl)-3-(3-nitro-4-propan-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-dimethylaminophenyl)-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-14(2)18-11-5-15(13-19(18)22(24)25)6-12-20(23)16-7-9-17(10-8-16)21(3)4/h5-14H,1-4H3/b12-6+