2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propanoic acid

Systemtic Name: 2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propanoic acid Openeye Name: 2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propanoic acid CAS Name: 2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propanoic acid IUPAC Name: 2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propanoic acid Traditional Name: 2-[[4-[(2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]propionic acid Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(C)C(=O)O

Isomeric SMILES

CC1NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(C)C(=O)O

InChI

InChI=1S/C18H21N3O4S/c1-12(18(22)23)20-26(24,25)15-9-7-14(8-10-15)11-21-13(2)19-16-5-3-4-6-17(16)21/h3-10,12-13,19-20H,11H2,1-2H3,(H,22,23)