N-[2-chloranyl-4-(naphthalen-2-yloxymethylamino)-5-oxidanyl-phenyl]-2-(3-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-[2-chloranyl-4-(naphthalen-2-yloxymethylamino)-5-oxidanyl-phenyl]-2-(3-methylphenyl)sulfonyl-butanamide Openeye Name: N-[2-chloro-5-hydroxy-4-(2-naphthyloxymethylamino)phenyl]-2-(m-tolylsulfonyl)butanamide CAS Name: N-[2-chloro-5-hydroxy-4-(2-naphthalenyloxymethylamino)phenyl]-2-(3-methylphenyl)sulfonylbutanamide IUPAC Name: N-[2-chloro-5-hydroxy-4-(naphthalen-2-yloxymethylamino)phenyl]-2-(3-methylphenyl)sulfonylbutanamide Traditional Name: N-[2-chloro-5-hydroxy-4-(2-naphthoxymethylamino)phenyl]-2-(m-tolylsulfonyl)butyramide Formula: C28H27ClN2O5S MolecularWeight: 539.04238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1Cl)NCOC2=CC3=CC=CC=C3C=C2)O)S(=O)(=O)C4=CC=CC(=C4)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1Cl)NCOC2=CC3=CC=CC=C3C=C2)O)S(=O)(=O)C4=CC=CC(=C4)C

InChI

InChI=1S/C28H27ClN2O5S/c1-3-27(37(34,35)22-10-6-7-18(2)13-22)28(33)31-24-16-26(32)25(15-23(24)29)30-17-36-21-12-11-19-8-4-5-9-20(19)14-21/h4-16,27,30,32H,3,17H2,1-2H3,(H,31,33)