6-iodanyl-2-[(E)-2-(4-nitrophenyl)ethenyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-2-[(E)-2-(4-nitrophenyl)ethenyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)vinyl]quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)vinyl]quinazolin-4-one Formula: C19H16IN3O4 MolecularWeight: 477.25251

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=NC3=C(C=C(C=C3)I)C(=O)N2CCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=NC3=C(C=C(C=C3)I)C(=O)N2CCCO)[N+](=O)[O-]

InChI

InChI=1S/C19H16IN3O4/c20-14-5-8-17-16(12-14)19(25)22(10-1-11-24)18(21-17)9-4-13-2-6-15(7-3-13)23(26)27/h2-9,12,24H,1,10-11H2/b9-4+