(2R)-2-ethyl-4-(3-methylbutyl)-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2R)-2-ethyl-4-(3-methylbutyl)-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-2-ethyl-4-isopentyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-2-ethyl-4-(3-methylbutyl)-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-2-ethyl-4-(3-methylbutyl)-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-2-ethyl-4-isoamyl-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-4-14-16(19)17(8-7-11(2)3)13-9-12(10-18)5-6-15(13)20-14/h5-6,9-11,14H,4,7-8H2,1-3H3/t14-/m1/s1