3-(3-cyanophenyl)-2-(quinolin-8-ylsulfonylamino)propanoic acid

Systemtic Name: 3-(3-cyanophenyl)-2-(quinolin-8-ylsulfonylamino)propanoic acid Openeye Name: 3-(3-cyanophenyl)-2-(8-quinolylsulfonylamino)propanoic acid CAS Name: 3-(3-cyanophenyl)-2-(8-quinolinylsulfonylamino)propanoic acid IUPAC Name: 3-(3-cyanophenyl)-2-(quinolin-8-ylsulfonylamino)propanoic acid Traditional Name: 3-(3-cyanophenyl)-2-(8-quinolylsulfonylamino)propionic acid Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC(CC3=CC=CC(=C3)C#N)C(=O)O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC(CC3=CC=CC(=C3)C#N)C(=O)O)N=CC=C2

InChI

InChI=1S/C19H15N3O4S/c20-12-14-5-1-4-13(10-14)11-16(19(23)24)22-27(25,26)17-8-2-6-15-7-3-9-21-18(15)17/h1-10,16,22H,11H2,(H,23,24)