4-[(3-iodanyl-5-methyl-phenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 4-[(3-iodanyl-5-methyl-phenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: 4-[(3-iodo-5-methyl-phenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: 4-[(3-iodo-5-methylphenyl)methyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 4-[(3-iodo-5-methylphenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: 4-(3-iodo-5-methyl-benzyl)-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C17H14INO3 MolecularWeight: 407.20243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)I)CN2C(=O)COC3=C2C=C(C=C3)C=O

Isomeric SMILES

CC1=CC(=CC(=C1)I)CN2C(=O)COC3=C2C=C(C=C3)C=O

InChI

InChI=1S/C17H14INO3/c1-11-4-13(6-14(18)5-11)8-19-15-7-12(9-20)2-3-16(15)22-10-17(19)21/h2-7,9H,8,10H2,1H3