(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,3-diphenylpropanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,3-diphenylpropanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3,3-diphenylpropanoate CAS Name: 3,3-diphenylpropanoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 3,3-diphenylpropanoate Traditional Name: 3,3-diphenylpropionic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S/c1-2-3-16-30-25-15-14-22(35(28,32)33)17-24(25)29-26(30)19-34-27(31)18-23(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-15,17,23H,2-3,16,18-19H2,1H3,(H2,28,32,33)