6-iodanyl-3-(2-methyl-1-oxidanyl-propan-2-yl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methyl-1-oxidanyl-propan-2-yl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one Openeye Name: 3-(2-hydroxy-1,1-dimethyl-ethyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)vinyl]quinazolin-4-one CAS Name: 3-(1-hydroxy-2-methylpropan-2-yl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-quinazolinone IUPAC Name: 3-(1-hydroxy-2-methylpropan-2-yl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one Traditional Name: 3-(2-hydroxy-1,1-dimethyl-ethyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)vinyl]quinazolin-4-one Formula: C20H18IN3O4 MolecularWeight: 491.27909

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)N1C(=NC2=C(C1=O)C=C(C=C2)I)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CO)N1C(=NC2=C(C1=O)C=C(C=C2)I)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18IN3O4/c1-20(2,12-25)23-18(10-5-13-3-7-15(8-4-13)24(27)28)22-17-9-6-14(21)11-16(17)19(23)26/h3-11,25H,12H2,1-2H3/b10-5+