heptyl 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methyl-indole-3-carboxylate

Systemtic Name: heptyl 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methyl-indole-3-carboxylate Openeye Name: heptyl 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methyl-indole-3-carboxylate CAS Name: 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methyl-3-indolecarboxylic acid heptyl ester IUPAC Name: heptyl 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methylindole-3-carboxylate Traditional Name: 1-(dimethylsulfamoyl)-5-(dimethylsulfamoylamino)-2-methyl-indole-3-carboxylic acid heptyl ester Formula: C21H34N4O6S2 MolecularWeight: 502.64786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(N(C2=C1C=C(C=C2)NS(=O)(=O)N(C)C)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCCCCCCOC(=O)C1=C(N(C2=C1C=C(C=C2)NS(=O)(=O)N(C)C)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C21H34N4O6S2/c1-7-8-9-10-11-14-31-21(26)20-16(2)25(33(29,30)24(5)6)19-13-12-17(15-18(19)20)22-32(27,28)23(3)4/h12-13,15,22H,7-11,14H2,1-6H3