2-[[(3Z)-3-[(pyrrol-1-ylamino)methylidene]indazol-6-yl]amino]benzoic acid

Systemtic Name: 2-[[(3Z)-3-[(pyrrol-1-ylamino)methylidene]indazol-6-yl]amino]benzoic acid Openeye Name: 2-[[(3Z)-3-[(pyrrol-1-ylamino)methylene]indazol-6-yl]amino]benzoic acid CAS Name: 2-[[(3Z)-3-[(1-pyrrolylamino)methylidene]-6-indazolyl]amino]benzoic acid IUPAC Name: 2-[[(3Z)-3-[(pyrrol-1-ylamino)methylidene]indazol-6-yl]amino]benzoic acid Traditional Name: 2-[[(3Z)-3-[(pyrrol-1-ylamino)methylene]indazol-6-yl]amino]benzoic acid Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC3=C(C=C2)C(=CNN4C=CC=C4)N=N3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC3=C(C=C2)/C(=C/NN4C=CC=C4)/N=N3

InChI

InChI=1S/C19H15N5O2/c25-19(26)15-5-1-2-6-16(15)21-13-7-8-14-17(11-13)22-23-18(14)12-20-24-9-3-4-10-24/h1-12,20-21H,(H,25,26)/b18-12-