4-[2-[3,4-bis(fluoranyl)phenyl]ethyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 4-[2-[3,4-bis(fluoranyl)phenyl]ethyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: 4-[2-(3,4-difluorophenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: 4-[2-(3,4-difluorophenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 4-[2-(3,4-difluorophenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: 4-[2-(3,4-difluorophenyl)ethyl]-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C17H13F2NO3 MolecularWeight: 317.286826

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C17H13F2NO3/c18-13-3-1-11(7-14(13)19)5-6-20-15-8-12(9-21)2-4-16(15)23-10-17(20)22/h1-4,7-9H,5-6,10H2