(2S)-2-ethyl-4-hexyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2S)-2-ethyl-4-hexyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2S)-2-ethyl-4-hexyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2S)-2-ethyl-4-hexyl-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2S)-2-ethyl-4-hexyl-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2S)-2-ethyl-4-hexyl-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)C=O)OC(C1=O)CC

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)C=O)O[C@H](C1=O)CC

InChI

InChI=1S/C17H23NO3/c1-3-5-6-7-10-18-14-11-13(12-19)8-9-16(14)21-15(4-2)17(18)20/h8-9,11-12,15H,3-7,10H2,1-2H3/t15-/m0/s1