2-[[1-(3,4-dimethoxyphenyl)sulfonylazetidin-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 2-[[1-(3,4-dimethoxyphenyl)sulfonylazetidin-2-yl]carbonylamino]hexanoic acid Openeye Name: 2-[[1-(3,4-dimethoxyphenyl)sulfonylazetidine-2-carbonyl]amino]hexanoic acid CAS Name: 2-[[[1-(3,4-dimethoxyphenyl)sulfonyl-2-azetidinyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[[1-(3,4-dimethoxyphenyl)sulfonylazetidine-2-carbonyl]amino]hexanoic acid Traditional Name: 2-[[1-(3,4-dimethoxyphenyl)sulfonylazetidine-2-carbonyl]amino]hexanoic acid Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1CCN1S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1CCN1S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H26N2O7S/c1-4-5-6-13(18(22)23)19-17(21)14-9-10-20(14)28(24,25)12-7-8-15(26-2)16(11-12)27-3/h7-8,11,13-14H,4-6,9-10H2,1-3H3,(H,19,21)(H,22,23)