6-iodanyl-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(2-methoxyphenyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-one Formula: C21H14IN3O5 MolecularWeight: 515.25743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H14IN3O5/c1-29-18-5-3-2-4-17(18)24-19(10-7-14-8-11-20(30-14)25(27)28)23-16-9-6-13(22)12-15(16)21(24)26/h2-12H,1H3/b10-7+