4-[[(4-iodophenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(4-iodophenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(4-iodoanilino)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[(4-iodoanilino)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(4-iodoanilino)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[(4-iodoanilino)methyl]coumarin Formula: C16H12INO3 MolecularWeight: 393.17585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC(=O)OC3=C2C=CC(=C3)O)I

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC(=O)OC3=C2C=CC(=C3)O)I

InChI

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