(2S)-6-ethanoyl-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-ethanoyl-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one Openeye Name: (2S)-6-acetyl-4-isopentyl-2-methyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-acetyl-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-acetyl-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one Traditional Name: (2S)-6-acetyl-4-isoamyl-2-methyl-1,4-benzoxazin-3-one Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-10(2)7-8-17-14-9-13(11(3)18)5-6-15(14)20-12(4)16(17)19/h5-6,9-10,12H,7-8H2,1-4H3/t12-/m0/s1