methyl 8-(naphthalen-2-ylsulfonylamino)-7-pyridin-3-yl-octanoate

Systemtic Name: methyl 8-(naphthalen-2-ylsulfonylamino)-7-pyridin-3-yl-octanoate Openeye Name: methyl 8-(2-naphthylsulfonylamino)-7-(3-pyridyl)octanoate CAS Name: 8-(2-naphthalenylsulfonylamino)-7-(3-pyridinyl)octanoic acid methyl ester IUPAC Name: methyl 8-(naphthalen-2-ylsulfonylamino)-7-pyridin-3-yloctanoate Traditional Name: 8-(2-naphthylsulfonylamino)-7-(3-pyridyl)caprylic acid methyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCC(CNS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C3=CN=CC=C3

Isomeric SMILES

COC(=O)CCCCCC(CNS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C3=CN=CC=C3

InChI

InChI=1S/C24H28N2O4S/c1-30-24(27)12-4-2-3-10-22(21-11-7-15-25-17-21)18-26-31(28,29)23-14-13-19-8-5-6-9-20(19)16-23/h5-9,11,13-17,22,26H,2-4,10,12,18H2,1H3