[(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino] 4-methoxybenzoate

Systemtic Name: [(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino] 4-methoxybenzoate Openeye Name: [(E)-(6-fluorothiochroman-4-ylidene)amino] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(E)-(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino] ester IUPAC Name: [(E)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(E)-(6-fluorothiochroman-4-ylidene)amino] ester Formula: C17H14FNO3S MolecularWeight: 331.361363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)ON=C2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)O/N=C/2\CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C17H14FNO3S/c1-21-13-5-2-11(3-6-13)17(20)22-19-15-8-9-23-16-7-4-12(18)10-14(15)16/h2-7,10H,8-9H2,1H3/b19-15+