(E)-3-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-[4-[(1-methyl-2-imidazolyl)methoxy]phenyl]-1-(4-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1-(4-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OCC3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)OCC3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4/c1-15-3-7-17(13-19(15)24(26)27)20(25)10-6-16-4-8-18(9-5-16)28-14-21-22-11-12-23(21)2/h3-13H,14H2,1-2H3/b10-6+