3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-ethenyl]amino]benzoic acid

Systemtic Name: 3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-ethenyl]amino]benzoic acid Openeye Name: 3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-vinyl]amino]benzoic acid CAS Name: 3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyanoethenyl]amino]benzoic acid IUPAC Name: 3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyanoethenyl]amino]benzoic acid Traditional Name: 3-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-vinyl]amino]benzoic acid Formula: C17H11N3O3 MolecularWeight: 305.28754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C(=CNC3=CC=CC(=C3)C(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)/C(=C/NC3=CC=CC(=C3)C(=O)O)/C#N

InChI

InChI=1S/C17H11N3O3/c18-9-12(16-20-14-6-1-2-7-15(14)23-16)10-19-13-5-3-4-11(8-13)17(21)22/h1-8,10,19H,(H,21,22)/b12-10+