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

Systemtic Name: (2S)-6-butanoyl-2-methyl-4-pentyl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-butanoyl-2-methyl-4-pentyl-1,4-benzoxazin-3-one CAS Name: (2S)-2-methyl-6-(1-oxobutyl)-4-pentyl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-butanoyl-2-methyl-4-pentyl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-amyl-6-butyryl-2-methyl-1,4-benzoxazin-3-one Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO3/c1-4-6-7-11-19-15-12-14(16(20)8-5-2)9-10-17(15)22-13(3)18(19)21/h9-10,12-13H,4-8,11H2,1-3H3/t13-/m0/s1