5-chloranyl-7-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(4-hydroxy-3-iodo-5-methoxy-phenyl)-(2-pyridylamino)methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(4-hydroxy-3-iodo-5-methoxyphenyl)-(2-pyridinylamino)methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(4-hydroxy-3-iodo-5-methoxyphenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(4-hydroxy-3-iodo-5-methoxy-phenyl)-(2-pyridylamino)methyl]quinolin-8-ol Formula: C22H17ClIN3O3 MolecularWeight: 533.74615

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(C2=CC(=C3C=CC=NC3=C2O)Cl)NC4=CC=CC=N4)I)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C(C2=CC(=C3C=CC=NC3=C2O)Cl)NC4=CC=CC=N4)I)O

InChI

InChI=1S/C22H17ClIN3O3/c1-30-17-10-12(9-16(24)22(17)29)19(27-18-6-2-3-7-25-18)14-11-15(23)13-5-4-8-26-20(13)21(14)28/h2-11,19,28-29H,1H3,(H,25,27)