4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)-9-prop-2-enyl-furo[3,2-g]chromen-5-one

Systemtic Name: 4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)-9-prop-2-enyl-furo[3,2-g]chromen-5-one Openeye Name: 9-allyl-4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)furo[3,2-g]chromen-5-one CAS Name: 4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)-9-prop-2-enyl-5-furo[3,2-g][1]benzopyranone IUPAC Name: 4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)-9-prop-2-enylfuro[3,2-g]chromen-5-one Traditional Name: 9-allyl-4-methoxy-6-(6-nitro-1H-benzimidazol-2-yl)furo[3,2-g]chromen-5-one Formula: C22H15N3O6 MolecularWeight: 417.371

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C3=C1C=CO3)CC=C)OC=C(C2=O)C4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=C(C3=C1C=CO3)CC=C)OC=C(C2=O)C4=NC5=C(N4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O6/c1-3-4-12-19-13(7-8-30-19)20(29-2)17-18(26)14(10-31-21(12)17)22-23-15-6-5-11(25(27)28)9-16(15)24-22/h3,5-10H,1,4H2,2H3,(H,23,24)