(E)-3-[4-[(2-piperidin-1-ylcarbonylphenyl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(2-piperidin-1-ylcarbonylphenyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[2-(piperidine-1-carbonyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[2-[oxo(1-piperidinyl)methyl]phenyl]sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[[2-(piperidine-1-carbonyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[2-(piperidine-1-carbonyl)phenyl]sulfamoyl]phenyl]acrylic acid Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)/C=C/C(=O)O

InChI

InChI=1S/C21H22N2O5S/c24-20(25)13-10-16-8-11-17(12-9-16)29(27,28)22-19-7-3-2-6-18(19)21(26)23-14-4-1-5-15-23/h2-3,6-13,22H,1,4-5,14-15H2,(H,24,25)/b13-10+