4-chloranyl-N-[5-chloranyl-4-[2-(4-dodecoxyphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-3-methyl-benzamide

Systemtic Name: 4-chloranyl-N-[5-chloranyl-4-[2-(4-dodecoxyphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-3-methyl-benzamide Openeye Name: 4-chloro-N-[5-chloro-4-[2-(4-dodecoxyphenyl)sulfonylbutanoylamino]-2-hydroxy-phenyl]-3-methyl-benzamide CAS Name: 4-chloro-N-[5-chloro-4-[[2-(4-dodecoxyphenyl)sulfonyl-1-oxobutyl]amino]-2-hydroxyphenyl]-3-methylbenzamide IUPAC Name: 4-chloro-N-[5-chloro-4-[2-(4-dodecoxyphenyl)sulfonylbutanoylamino]-2-hydroxyphenyl]-3-methylbenzamide Traditional Name: 4-chloro-N-[5-chloro-2-hydroxy-4-[2-(4-lauryloxyphenyl)sulfonylbutanoylamino]phenyl]-3-methyl-benzamide Formula: C36H46Cl2N2O6S MolecularWeight: 705.73124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC(=C(C=C3)Cl)C)O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC(=C(C=C3)Cl)C)O

InChI

InChI=1S/C36H46Cl2N2O6S/c1-4-6-7-8-9-10-11-12-13-14-21-46-27-16-18-28(19-17-27)47(44,45)34(5-2)36(43)39-31-24-33(41)32(23-30(31)38)40-35(42)26-15-20-29(37)25(3)22-26/h15-20,22-24,34,41H,4-14,21H2,1-3H3,(H,39,43)(H,40,42)