4-[(4-nitroimidazol-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one

Systemtic Name: 4-[(4-nitroimidazol-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Openeye Name: 4-[(4-nitroimidazol-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one CAS Name: 4-[(4-nitro-1-imidazolyl)methyl]-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-2-one IUPAC Name: 4-[(4-nitroimidazol-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Traditional Name: 4-[(4-nitroimidazol-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Formula: C16H13N3O4 MolecularWeight: 311.29212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CN4C=C(N=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CN4C=C(N=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c20-16-6-12(7-18-8-15(17-9-18)19(21)22)13-4-10-2-1-3-11(10)5-14(13)23-16/h4-6,8-9H,1-3,7H2