3-[[4-[(E)-3-(3-cyanophenyl)prop-2-enoyl]phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-[[4-[(E)-3-(3-cyanophenyl)prop-2-enoyl]phenyl]sulfonylamino]propanoic acid Openeye Name: 3-[[4-[(E)-3-(3-cyanophenyl)prop-2-enoyl]phenyl]sulfonylamino]propanoic acid CAS Name: 3-[[4-[(E)-3-(3-cyanophenyl)-1-oxoprop-2-enyl]phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-[[4-[(E)-3-(3-cyanophenyl)prop-2-enoyl]phenyl]sulfonylamino]propanoic acid Traditional Name: 3-[[4-[(E)-3-(3-cyanophenyl)acryloyl]phenyl]sulfonylamino]propionic acid Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC(=O)O)C#N

InChI

InChI=1S/C19H16N2O5S/c20-13-15-3-1-2-14(12-15)4-9-18(22)16-5-7-17(8-6-16)27(25,26)21-11-10-19(23)24/h1-9,12,21H,10-11H2,(H,23,24)/b9-4+