(2S)-2-methyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2S)-2-methyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2S)-4-isopropyl-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2S)-2-methyl-3-oxo-4-propan-2-yl-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2S)-2-methyl-3-oxo-4-propan-2-yl-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2S)-4-isopropyl-3-keto-2-methyl-1,4-benzoxazine-6-carbaldehyde Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)C(C)C

Isomeric SMILES

C[C@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)C(C)C

InChI

InChI=1S/C13H15NO3/c1-8(2)14-11-6-10(7-15)4-5-12(11)17-9(3)13(14)16/h4-9H,1-3H3/t9-/m0/s1