2-bromanyl-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxy-benzamide

Systemtic Name: 2-bromanyl-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxy-benzamide Openeye Name: 2-bromo-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxy-benzamide CAS Name: 2-bromo-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxybenzamide IUPAC Name: 2-bromo-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxybenzamide Traditional Name: 2-bromo-N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-3,4,5-trimethoxy-benzamide Formula: C26H27BrClNO6S MolecularWeight: 596.91768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C(=C2Br)OC)OC)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C(=C2Br)OC)OC)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27BrClNO6S/c1-5-6-7-17-8-12-19(13-9-17)29(36(31,32)20-14-10-18(28)11-15-20)26(30)21-16-22(33-2)24(34-3)25(35-4)23(21)27/h8-16H,5-7H2,1-4H3