(2S)-4-butyl-2-phenyl-6-propanoyl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-4-butyl-2-phenyl-6-propanoyl-1,4-benzoxazin-3-one Openeye Name: (2S)-4-butyl-2-phenyl-6-propanoyl-1,4-benzoxazin-3-one CAS Name: (2S)-4-butyl-6-(1-oxopropyl)-2-phenyl-1,4-benzoxazin-3-one IUPAC Name: (2S)-4-butyl-2-phenyl-6-propanoyl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-butyl-2-phenyl-6-propionyl-1,4-benzoxazin-3-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)C(=O)CC)OC(C1=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)C(=O)CC)O[C@H](C1=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c1-3-5-13-22-17-14-16(18(23)4-2)11-12-19(17)25-20(21(22)24)15-9-7-6-8-10-15/h6-12,14,20H,3-5,13H2,1-2H3/t20-/m0/s1