(2S)-6-butanoyl-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-butanoyl-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-butanoyl-2-isopropyl-4-pentyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-(1-oxobutyl)-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-butanoyl-4-pentyl-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-amyl-6-butyryl-2-isopropyl-1,4-benzoxazin-3-one Formula: C20H29NO3 MolecularWeight: 331.44916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=CC(=C2)C(=O)CCC)OC(C1=O)C(C)C

Isomeric SMILES

CCCCCN1C2=C(C=CC(=C2)C(=O)CCC)O[C@H](C1=O)C(C)C

InChI

InChI=1S/C20H29NO3/c1-5-7-8-12-21-16-13-15(17(22)9-6-2)10-11-18(16)24-19(14(3)4)20(21)23/h10-11,13-14,19H,5-9,12H2,1-4H3/t19-/m0/s1