N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-iodanyl-benzamide

Systemtic Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-iodanyl-benzamide Openeye Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]-3-iodo-benzamide CAS Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]-3-iodobenzamide IUPAC Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]-3-iodobenzamide Traditional Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]-3-iodo-benzamide Formula: C20H13IN2O3 MolecularWeight: 456.23329

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=CC(=CC3=O)NC(=O)C4=CC(=CC=C4)I)O2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C\3/C=CC(=CC3=O)NC(=O)C4=CC(=CC=C4)I)/O2

InChI

InChI=1S/C20H13IN2O3/c21-13-5-3-4-12(10-13)19(25)22-14-8-9-15(17(24)11-14)20-23-16-6-1-2-7-18(16)26-20/h1-11,23H,(H,22,25)/b20-15+