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

Systemtic Name: octyl 2-methyl-5-(phenylsulfonylamino)benzo[g][1]benzofuran-3-carboxylate Openeye Name: octyl 5-(benzenesulfonamido)-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-(benzenesulfonamido)-2-methyl-3-benzo[g]benzofurancarboxylic acid octyl ester IUPAC Name: octyl 5-(benzenesulfonamido)-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-(benzenesulfonamido)-2-methyl-benzo[g]benzofuran-3-carboxylic acid octyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31NO5S/c1-3-4-5-6-7-13-18-33-28(30)26-20(2)34-27-23-17-12-11-16-22(23)25(19-24(26)27)29-35(31,32)21-14-9-8-10-15-21/h8-12,14-17,19,29H,3-7,13,18H2,1-2H3