N-[5-chloranyl-4-[11-(4-methylphenyl)sulfonylundecanoylamino]-2-oxidanyl-phenyl]benzamide

Systemtic Name: N-[5-chloranyl-4-[11-(4-methylphenyl)sulfonylundecanoylamino]-2-oxidanyl-phenyl]benzamide Openeye Name: N-[5-chloro-2-hydroxy-4-[11-(p-tolylsulfonyl)undecanoylamino]phenyl]benzamide CAS Name: N-[5-chloro-2-hydroxy-4-[[11-(4-methylphenyl)sulfonyl-1-oxoundecyl]amino]phenyl]benzamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[11-(4-methylphenyl)sulfonylundecanoylamino]phenyl]benzamide Traditional Name: N-[5-chloro-2-hydroxy-4-(11-tosylundecanoylamino)phenyl]benzamide Formula: C31H37ClN2O5S MolecularWeight: 585.15388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCCCCCCCCC(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCCCCCCCCC(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C31H37ClN2O5S/c1-23-16-18-25(19-17-23)40(38,39)20-12-7-5-3-2-4-6-11-15-30(36)33-27-22-29(35)28(21-26(27)32)34-31(37)24-13-9-8-10-14-24/h8-10,13-14,16-19,21-22,35H,2-7,11-12,15,20H2,1H3,(H,33,36)(H,34,37)