2-[[3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[3-[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[3-[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]phenyl]sulfonylamino]acetic acid Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C20H17N3O5S/c24-19(10-9-15-12-21-23(14-15)17-6-2-1-3-7-17)16-5-4-8-18(11-16)29(27,28)22-13-20(25)26/h1-12,14,22H,13H2,(H,25,26)/b10-9+