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

Systemtic Name: (2S)-2-methyl-4-(2-methylpropyl)-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2S)-4-isobutyl-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2S)-2-methyl-4-(2-methylpropyl)-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2S)-2-methyl-4-(2-methylpropyl)-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2S)-4-isobutyl-3-keto-2-methyl-1,4-benzoxazine-6-carbaldehyde Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO3/c1-9(2)7-15-12-6-11(8-16)4-5-13(12)18-10(3)14(15)17/h4-6,8-10H,7H2,1-3H3/t10-/m0/s1