4-[(3-iodanylphenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 4-[(3-iodanylphenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: 4-[(3-iodophenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: 4-[(3-iodophenyl)methyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 4-[(3-iodophenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: 4-(3-iodobenzyl)-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C16H12INO3 MolecularWeight: 393.17585

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC(=CC=C3)I

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC(=CC=C3)I

InChI

InChI=1S/C16H12INO3/c17-13-3-1-2-11(6-13)8-18-14-7-12(9-19)4-5-15(14)21-10-16(18)20/h1-7,9H,8,10H2