3-(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)propanoate

Systemtic Name: 3-(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)propanoate Openeye Name: 3-(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)propanoate CAS Name: 3-[5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]propanoate IUPAC Name: 3-(5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)propanoate Traditional Name: 3-(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)propionate Formula: C17H22N3O5S- MolecularWeight: 380.43868

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)[O-]

InChI

InChI=1S/C17H23N3O5S/c1-2-7-20-15-4-3-13(26(23,24)19-8-10-25-11-9-19)12-14(15)18-16(20)5-6-17(21)22/h3-4,12H,2,5-11H2,1H3,(H,21,22)/p-1