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

Systemtic Name: heptyl 2-methyl-5-(phenylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate Openeye Name: heptyl 5-(benzenesulfonamido)-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-(benzenesulfonamido)-2-methyl-3-benzo[g]benzofurancarboxylic acid heptyl ester IUPAC Name: heptyl 5-(benzenesulfonamido)-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-(benzenesulfonamido)-2-methyl-benzo[g]benzofuran-3-carboxylic acid heptyl ester Formula: C27H29NO5S MolecularWeight: 479.58786

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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=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C27H29NO5S/c1-3-4-5-6-12-17-32-27(29)25-19(2)33-26-22-16-11-10-15-21(22)24(18-23(25)26)28-34(30,31)20-13-8-7-9-14-20/h7-11,13-16,18,28H,3-6,12,17H2,1-2H3