(phenylmethyl) 2-methyl-5-(naphthalen-1-ylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-5-(naphthalen-1-ylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate Openeye Name: benzyl 2-methyl-5-(1-naphthylsulfonylamino)benzo[g]benzofuran-3-carboxylate CAS Name: 2-methyl-5-(1-naphthalenylsulfonylamino)-3-benzo[g]benzofurancarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-5-(naphthalen-1-ylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate Traditional Name: 2-methyl-5-(1-naphthylsulfonylamino)benzo[g]benzofuran-3-carboxylic acid benzyl ester Formula: C31H23NO5S MolecularWeight: 521.58302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C31H23NO5S/c1-20-29(31(33)36-19-21-10-3-2-4-11-21)26-18-27(24-15-7-8-16-25(24)30(26)37-20)32-38(34,35)28-17-9-13-22-12-5-6-14-23(22)28/h2-18,32H,19H2,1H3