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

Systemtic Name: heptyl 2-methyl-5-(naphthalen-1-ylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate Openeye Name: heptyl 2-methyl-5-(1-naphthylsulfonylamino)benzo[g]benzofuran-3-carboxylate CAS Name: 2-methyl-5-(1-naphthalenylsulfonylamino)-3-benzo[g]benzofurancarboxylic acid heptyl ester IUPAC Name: heptyl 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 heptyl ester Formula: C31H31NO5S MolecularWeight: 529.64654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CCCCCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C31H31NO5S/c1-3-4-5-6-11-19-36-31(33)29-21(2)37-30-25-17-10-9-16-24(25)27(20-26(29)30)32-38(34,35)28-18-12-14-22-13-7-8-15-23(22)28/h7-10,12-18,20,32H,3-6,11,19H2,1-2H3