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

Systemtic Name: 5-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-ethenyl]amino]-2-oxidanyl-benzoic acid Openeye Name: 5-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-vinyl]amino]-2-hydroxy-benzoic acid CAS Name: 5-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyanoethenyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyanoethenyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[(E)-2-(1,3-benzoxazol-2-yl)-2-cyano-vinyl]amino]-2-hydroxy-benzoic acid Formula: C17H11N3O4 MolecularWeight: 321.28694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11N3O4/c18-8-10(16-20-13-3-1-2-4-15(13)24-16)9-19-11-5-6-14(21)12(7-11)17(22)23/h1-7,9,19,21H,(H,22,23)/b10-9+