(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)acrylic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O6S/c1-4-5-12-26-19-9-8-17(33(24,28)29)14-18(19)25-22(26)15-32-23(27)11-7-16-6-10-20(30-2)21(13-16)31-3/h6-11,13-14H,4-5,12,15H2,1-3H3,(H2,24,28,29)/b11-7+