heptyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-methyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: heptyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-methyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: heptyl 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-methyl-3-benzo[g]benzofurancarboxylic acid heptyl ester IUPAC Name: heptyl 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-methyl-benzo[g]benzofuran-3-carboxylic acid heptyl ester Formula: C28H30ClNO5S MolecularWeight: 528.0595

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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(=C(C=C4)Cl)C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H30ClNO5S/c1-4-5-6-7-10-15-34-28(31)26-19(3)35-27-22-12-9-8-11-21(22)25(17-23(26)27)30-36(32,33)20-13-14-24(29)18(2)16-20/h8-9,11-14,16-17,30H,4-7,10,15H2,1-3H3