(E)-3-[4-[(3-azanyl-3-oxidanylidene-propyl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(3-azanyl-3-oxidanylidene-propyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(3-amino-3-oxo-propyl)sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(3-amino-3-oxopropyl)sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(3-amino-3-oxopropyl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(3-amino-3-keto-propyl)sulfamoyl]phenyl]acrylic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)O)S(=O)(=O)NCCC(=O)N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)O)S(=O)(=O)NCCC(=O)N

InChI

InChI=1S/C12H14N2O5S/c13-11(15)7-8-14-20(18,19)10-4-1-9(2-5-10)3-6-12(16)17/h1-6,14H,7-8H2,(H2,13,15)(H,16,17)/b6-3+