(E)-1-[2-(2-diethylaminoethyloxy)-5-nitro-phenyl]-3-phenyl-prop-2-en-1-one hydrobromide

Systemtic Name: (E)-1-[2-(2-diethylaminoethyloxy)-5-nitro-phenyl]-3-phenyl-prop-2-en-1-one hydrobromide Openeye Name: (E)-1-[2-(2-diethylaminoethyloxy)-5-nitro-phenyl]-3-phenyl-prop-2-en-1-one hydrobromide CAS Name: (E)-1-[2-(2-diethylaminoethyloxy)-5-nitrophenyl]-3-phenyl-2-propen-1-one hydrobromide IUPAC Name: (E)-1-[2-(2-diethylaminoethyloxy)-5-nitrophenyl]-3-phenylprop-2-en-1-one hydrobromide Traditional Name: (E)-1-[2-(2-diethylaminoethyloxy)-5-nitro-phenyl]-3-phenyl-prop-2-en-1-one hydrobromide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C=CC2=CC=CC=C2.Br

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)/C=C/C2=CC=CC=C2.Br

InChI

InChI=1S/C21H24N2O4.BrH/c1-3-22(4-2)14-15-27-21-13-11-18(23(25)26)16-19(21)20(24)12-10-17-8-6-5-7-9-17;/h5-13,16H,3-4,14-15H2,1-2H3;1H/b12-10+;