N-[5-chloranyl-2-oxidanyl-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[5-chloranyl-2-oxidanyl-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]naphthalene-2-carboxamide Openeye Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]naphthalene-2-carboxamide CAS Name: N-[5-chloro-2-hydroxy-4-[[1-oxo-2-(3-pentadecylphenyl)sulfonylbutyl]amino]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]naphthalene-2-carboxamide Traditional Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2-naphthamide Formula: C42H53ClN2O5S MolecularWeight: 733.39862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C42H53ClN2O5S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-31-21-19-24-35(27-31)51(49,50)40(4-2)42(48)44-37-30-39(46)38(29-36(37)43)45-41(47)34-26-25-32-22-17-18-23-33(32)28-34/h17-19,21-30,40,46H,3-16,20H2,1-2H3,(H,44,48)(H,45,47)