(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-phenylprop-2-enoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-phenylprop-2-enoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-2-3-13-24-19-11-10-17(29(22,26)27)14-18(19)23-20(24)15-28-21(25)12-9-16-7-5-4-6-8-16/h4-12,14H,2-3,13,15H2,1H3,(H2,22,26,27)/b12-9+