6-iodanyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-(1-phenylethyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-(1-phenylethyl)quinazolin-4-one Openeye Name: 6-iodo-2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-(1-phenylethyl)quinazolin-4-one CAS Name: 6-iodo-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-(1-phenylethyl)-4-quinazolinone IUPAC Name: 6-iodo-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-(1-phenylethyl)quinazolin-4-one Traditional Name: 6-iodo-2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-(1-phenylethyl)quinazolin-4-one Formula: C22H16IN3O4 MolecularWeight: 513.28461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H16IN3O4/c1-14(15-5-3-2-4-6-15)25-20(11-8-17-9-12-21(30-17)26(28)29)24-19-10-7-16(23)13-18(19)22(25)27/h2-14H,1H3/b11-8+