N1-(3-chloranyl-2-methyl-phenyl)-4-oxidanyl-N3-pyridin-3-yl-benzene-1,3-disulfonamide

Systemtic Name: N1-(3-chloranyl-2-methyl-phenyl)-4-oxidanyl-N3-pyridin-3-yl-benzene-1,3-disulfonamide Openeye Name: N1-(3-chloro-2-methyl-phenyl)-4-hydroxy-N3-(3-pyridyl)benzene-1,3-disulfonamide CAS Name: N1-(3-chloro-2-methylphenyl)-4-hydroxy-N3-(3-pyridinyl)benzene-1,3-disulfonamide IUPAC Name: 1-N-(3-chloro-2-methylphenyl)-4-hydroxy-3-N-pyridin-3-ylbenzene-1,3-disulfonamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-hydroxy-N'-(3-pyridyl)benzene-1,3-disulfonamide Formula: C18H16ClN3O5S2 MolecularWeight: 453.91974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NS(=O)(=O)C2=CC(=C(C=C2)O)S(=O)(=O)NC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NS(=O)(=O)C2=CC(=C(C=C2)O)S(=O)(=O)NC3=CN=CC=C3

InChI

InChI=1S/C18H16ClN3O5S2/c1-12-15(19)5-2-6-16(12)22-28(24,25)14-7-8-17(23)18(10-14)29(26,27)21-13-4-3-9-20-11-13/h2-11,21-23H,1H3