(E)-1-[4-(2-chloroethyloxy)phenyl]-3-(1-methyl-5-nitro-imidazol-2-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(2-chloroethyloxy)phenyl]-3-(1-methyl-5-nitro-imidazol-2-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(2-chloroethoxy)phenyl]-3-(1-methyl-5-nitro-imidazol-2-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(2-chloroethoxy)phenyl]-3-(1-methyl-5-nitro-2-imidazolyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(2-chloroethoxy)phenyl]-3-(1-methyl-5-nitroimidazol-2-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(2-chloroethoxy)phenyl]-3-(1-methyl-5-nitro-imidazol-2-yl)prop-2-en-1-one Formula: C15H14ClN3O4 MolecularWeight: 335.74236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C=CC(=O)C2=CC=C(C=C2)OCCCl)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1/C=C/C(=O)C2=CC=C(C=C2)OCCCl)[N+](=O)[O-]

InChI

InChI=1S/C15H14ClN3O4/c1-18-14(17-10-15(18)19(21)22)7-6-13(20)11-2-4-12(5-3-11)23-9-8-16/h2-7,10H,8-9H2,1H3/b7-6+