2-methyl-3-[(6-nitrobenzimidazol-1-yl)methyl]chromen-4-one

Systemtic Name: 2-methyl-3-[(6-nitrobenzimidazol-1-yl)methyl]chromen-4-one Openeye Name: 2-methyl-3-[(6-nitrobenzimidazol-1-yl)methyl]chromen-4-one CAS Name: 2-methyl-3-[(6-nitro-1-benzimidazolyl)methyl]-1-benzopyran-4-one IUPAC Name: 2-methyl-3-[(6-nitrobenzimidazol-1-yl)methyl]chromen-4-one Traditional Name: 2-methyl-3-[(6-nitrobenzimidazol-1-yl)methyl]chromone Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2O1)CN3C=NC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2O1)CN3C=NC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O4/c1-11-14(18(22)13-4-2-3-5-17(13)25-11)9-20-10-19-15-7-6-12(21(23)24)8-16(15)20/h2-8,10H,9H2,1H3