(E)-1-(4-bromophenyl)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromophenyl)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-bromophenyl)-3-(3-nitro-4-pyrrolidin-1-yl-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-bromophenyl)-3-[3-nitro-4-(1-pyrrolidinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-bromophenyl)-3-(3-nitro-4-pyrrolidin-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-bromophenyl)-3-(3-nitro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C19H17BrN2O3 MolecularWeight: 401.25388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C=CC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)/C=C/C(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H17BrN2O3/c20-16-7-5-15(6-8-16)19(23)10-4-14-3-9-17(18(13-14)22(24)25)21-11-1-2-12-21/h3-10,13H,1-2,11-12H2/b10-4+