2-[(1-methylimidazol-2-yl)sulfonylmethyl]-5-phenyl-pentanoic acid

Systemtic Name: 2-[(1-methylimidazol-2-yl)sulfonylmethyl]-5-phenyl-pentanoic acid Openeye Name: 2-[(1-methylimidazol-2-yl)sulfonylmethyl]-5-phenyl-pentanoic acid CAS Name: 2-[(1-methyl-2-imidazolyl)sulfonylmethyl]-5-phenylpentanoic acid IUPAC Name: 2-[(1-methylimidazol-2-yl)sulfonylmethyl]-5-phenylpentanoic acid Traditional Name: 2-[(1-methylimidazol-2-yl)sulfonylmethyl]-5-phenyl-valeric acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1S(=O)(=O)CC(CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN1C=CN=C1S(=O)(=O)CC(CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H20N2O4S/c1-18-11-10-17-16(18)23(21,22)12-14(15(19)20)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-11,14H,5,8-9,12H2,1H3,(H,19,20)