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

Systemtic Name: 6-iodanyl-2-[(E)-2-(3-nitrophenyl)ethenyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-[(E)-2-(3-nitrophenyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-2-[(E)-2-(3-nitrophenyl)ethenyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-6-iodo-2-[(E)-2-(3-nitrophenyl)ethenyl]quinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-[(E)-2-(3-nitrophenyl)vinyl]quinazolin-4-one Formula: C23H16IN3O3 MolecularWeight: 509.29591

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16IN3O3/c24-18-10-11-21-20(14-18)23(28)26(15-17-5-2-1-3-6-17)22(25-21)12-9-16-7-4-8-19(13-16)27(29)30/h1-14H,15H2/b12-9+