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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C=O)OC(C1=O)C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C=O)O[C@H](C1=O)C

InChI

InChI=1S/C13H15NO3/c1-3-6-14-11-7-10(8-15)4-5-12(11)17-9(2)13(14)16/h4-5,7-9H,3,6H2,1-2H3/t9-/m0/s1