3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]chromen-4-one

Systemtic Name: 3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]chromen-4-one Openeye Name: 3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]chromen-4-one CAS Name: 3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitro-1-imidazolyl)ethoxy]-1-benzopyran-4-one IUPAC Name: 3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitroimidazol-1-yl)ethoxy]chromen-4-one Traditional Name: 3-(4-hydroxyphenyl)-7-[2-(2-methyl-5-nitro-imidazol-1-yl)ethoxy]chromone Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O6/c1-13-22-11-20(24(27)28)23(13)8-9-29-16-6-7-17-19(10-16)30-12-18(21(17)26)14-2-4-15(25)5-3-14/h2-7,10-12,25H,8-9H2,1H3