5-(4-hydroxyphenyl)-9-iodanyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol

Systemtic Name: 5-(4-hydroxyphenyl)-9-iodanyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Openeye Name: 5-(4-hydroxyphenyl)-9-iodo-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol CAS Name: 5-(4-hydroxyphenyl)-9-iodo-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol IUPAC Name: 5-(4-hydroxyphenyl)-9-iodo-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Traditional Name: 5-(4-hydroxyphenyl)-9-iodo-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Formula: C16H16INO3 MolecularWeight: 397.20761

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C2=CC(=C(C(=C21)I)O)O)C3=CC=C(C=C3)O

Isomeric SMILES

C1CNCC(C2=CC(=C(C(=C21)I)O)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C16H16INO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2