(Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-3-phenyl-prop-2-en-1-one hydrobromide

Systemtic Name: (Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-3-phenyl-prop-2-en-1-one hydrobromide Openeye Name: (Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-3-phenyl-prop-2-en-1-one hydrobromide CAS Name: (Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-3-phenyl-2-propen-1-one hydrobromide IUPAC Name: (Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-3-phenylprop-2-en-1-one hydrobromide Traditional Name: (Z)-2-(2-diethylaminoethyloxy)-1-(3-nitrophenyl)-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)CCOC(=CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-].Br

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4.BrH/c1-3-22(4-2)13-14-27-20(15-17-9-6-5-7-10-17)21(24)18-11-8-12-19(16-18)23(25)26;/h5-12,15-16H,3-4,13-14H2,1-2H3;1H/b20-15-;