(2H-thiochromen-4-ylamino) 4-fluoranylbenzoate

Systemtic Name: (2H-thiochromen-4-ylamino) 4-fluoranylbenzoate Openeye Name: (2H-thiochromen-4-ylamino) 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid (2H-1-benzothiopyran-4-ylamino) ester IUPAC Name: (2H-thiochromen-4-ylamino) 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid (2H-thiochromen-4-ylamino) ester Formula: C16H12FNO2S MolecularWeight: 301.335383

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C2=CC=CC=C2S1)NOC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1C=C(C2=CC=CC=C2S1)NOC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H12FNO2S/c17-12-7-5-11(6-8-12)16(19)20-18-14-9-10-21-15-4-2-1-3-13(14)15/h1-9,18H,10H2