methyl 3-[4-(naphthalen-2-ylsulfonylamino)butanoyloxymethyl]benzoate

Systemtic Name: methyl 3-[4-(naphthalen-2-ylsulfonylamino)butanoyloxymethyl]benzoate Openeye Name: methyl 3-[4-(2-naphthylsulfonylamino)butanoyloxymethyl]benzoate CAS Name: 3-[[4-(2-naphthalenylsulfonylamino)-1-oxobutoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-(naphthalen-2-ylsulfonylamino)butanoyloxymethyl]benzoate Traditional Name: 3-[4-(2-naphthylsulfonylamino)butanoyloxymethyl]benzoic acid methyl ester Formula: C23H23NO6S MolecularWeight: 441.49682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)CCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)CCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H23NO6S/c1-29-23(26)20-9-4-6-17(14-20)16-30-22(25)10-5-13-24-31(27,28)21-12-11-18-7-2-3-8-19(18)15-21/h2-4,6-9,11-12,14-15,24H,5,10,13,16H2,1H3