4-[(2E)-2-[1-(1,3-benzothiazol-2-yldiazenyl)butylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-[1-(1,3-benzothiazol-2-yldiazenyl)butylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[1-(1,3-benzothiazol-2-ylazo)butylidene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[1-(1,3-benzothiazol-2-ylazo)butylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[1-(1,3-benzothiazol-2-yldiazenyl)butylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-[1-(1,3-benzothiazol-2-ylazo)butylidene]hydrazino]benzoic acid Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC1=CC=C(C=C1)C(=O)O)N=NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC/C(=N\NC1=CC=C(C=C1)C(=O)O)/N=NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17N5O2S/c1-2-5-16(21-20-13-10-8-12(9-11-13)17(24)25)22-23-18-19-14-6-3-4-7-15(14)26-18/h3-4,6-11,20H,2,5H2,1H3,(H,24,25)/b21-16+,23-22?