2-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)ethanoic acid

Systemtic Name: 2-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)ethanoic acid Openeye Name: 2-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)acetic acid CAS Name: 2-[1-butyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]acetic acid IUPAC Name: 2-(1-butyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)acetic acid Traditional Name: 2-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)acetic acid Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CC(=O)O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CC(=O)O

InChI

InChI=1S/C17H23N3O5S/c1-2-3-6-20-15-5-4-13(11-14(15)18-16(20)12-17(21)22)26(23,24)19-7-9-25-10-8-19/h4-5,11H,2-3,6-10,12H2,1H3,(H,21,22)