(Z)-3-[[2-chloranyl-5-(2-methylheptadecan-2-ylsulfamoyl)phenyl]amino]-3-ethoxy-prop-2-enoic acid

Systemtic Name: (Z)-3-[[2-chloranyl-5-(2-methylheptadecan-2-ylsulfamoyl)phenyl]amino]-3-ethoxy-prop-2-enoic acid Openeye Name: (Z)-3-[2-chloro-5-(1,1-dimethylhexadecylsulfamoyl)anilino]-3-ethoxy-prop-2-enoic acid CAS Name: (Z)-3-[2-chloro-5-(2-methylheptadecan-2-ylsulfamoyl)anilino]-3-ethoxy-2-propenoic acid IUPAC Name: (Z)-3-[2-chloro-5-(2-methylheptadecan-2-ylsulfamoyl)anilino]-3-ethoxyprop-2-enoic acid Traditional Name: (Z)-3-[2-chloro-5-(1,1-dimethylhexadecylsulfamoyl)anilino]-3-ethoxy-acrylic acid Formula: C29H49ClN2O5S MolecularWeight: 573.22776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=CC(=O)O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)N/C(=C/C(=O)O)/OCC

InChI

InChI=1S/C29H49ClN2O5S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-21-29(3,4)32-38(35,36)24-19-20-25(30)26(22-24)31-27(37-6-2)23-28(33)34/h19-20,22-23,31-32H,5-18,21H2,1-4H3,(H,33,34)/b27-23-