(4Z)-4-(7-ethenyl-5-oxidanyl-3H-1,3-benzoxazol-2-ylidene)-2-fluoranyl-cyclohexa-2,5-dien-1-one hydrate

Systemtic Name: (4Z)-4-(7-ethenyl-5-oxidanyl-3H-1,3-benzoxazol-2-ylidene)-2-fluoranyl-cyclohexa-2,5-dien-1-one hydrate Openeye Name: (4Z)-2-fluoro-4-(5-hydroxy-7-vinyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrate CAS Name: (4Z)-4-(7-ethenyl-5-hydroxy-3H-1,3-benzoxazol-2-ylidene)-2-fluoro-1-cyclohexa-2,5-dienone hydrate IUPAC Name: (4Z)-4-(7-ethenyl-5-hydroxy-3H-1,3-benzoxazol-2-ylidene)-2-fluorocyclohexa-2,5-dien-1-one hydrate Traditional Name: (4Z)-2-fluoro-4-(5-hydroxy-7-vinyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrate Formula: C15H12FNO4 MolecularWeight: 289.258483

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC(=CC2=C1OC(=C3C=CC(=O)C(=C3)F)N2)O.O

Isomeric SMILES

C=CC1=CC(=CC2=C1O/C(=C\3/C=CC(=O)C(=C3)F)/N2)O.O

InChI

InChI=1S/C15H10FNO3.H2O/c1-2-8-5-10(18)7-12-14(8)20-15(17-12)9-3-4-13(19)11(16)6-9;/h2-7,17-18H,1H2;1H2/b15-9-;