4-[(2E)-2-(8-fluoranyl-2,3-dihydrothiochromen-4-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-(8-fluoranyl-2,3-dihydrothiochromen-4-ylidene)hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-(8-fluorothiochroman-4-ylidene)hydrazino]benzoic acid CAS Name: 4-[(2E)-2-(8-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-(8-fluoro-2,3-dihydrothiochromen-4-ylidene)hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-(8-fluorothiochroman-4-ylidene)hydrazino]benzoic acid Formula: C16H13FN2O2S MolecularWeight: 316.350023

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1=NNC3=CC=C(C=C3)C(=O)O)C=CC=C2F

Isomeric SMILES

C\1CSC2=C(/C1=N/NC3=CC=C(C=C3)C(=O)O)C=CC=C2F

InChI

InChI=1S/C16H13FN2O2S/c17-13-3-1-2-12-14(8-9-22-15(12)13)19-18-11-6-4-10(5-7-11)16(20)21/h1-7,18H,8-9H2,(H,20,21)/b19-14+