5-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-methyl-4-nitro-imidazole

Systemtic Name: 5-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-methyl-4-nitro-imidazole Openeye Name: 5-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-methyl-4-nitro-imidazole CAS Name: 5-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-methyl-4-nitroimidazole IUPAC Name: 5-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-methyl-4-nitroimidazole Traditional Name: 5-(2,2-dimethylcoumaran-7-yl)oxy-1-methyl-4-nitro-imidazole Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OC3=C(N=CN3C)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC3=C(N=CN3C)[N+](=O)[O-])C

InChI

InChI=1S/C14H15N3O4/c1-14(2)7-9-5-4-6-10(11(9)21-14)20-13-12(17(18)19)15-8-16(13)3/h4-6,8H,7H2,1-3H3