(2R)-6-butanoyl-4-(2-methylpropyl)-2-phenyl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-butanoyl-4-(2-methylpropyl)-2-phenyl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-butanoyl-4-isobutyl-2-phenyl-1,4-benzoxazin-3-one CAS Name: (2R)-4-(2-methylpropyl)-6-(1-oxobutyl)-2-phenyl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-butanoyl-4-(2-methylpropyl)-2-phenyl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-butyryl-4-isobutyl-2-phenyl-1,4-benzoxazin-3-one Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3/c1-4-8-19(24)17-11-12-20-18(13-17)23(14-15(2)3)22(25)21(26-20)16-9-6-5-7-10-16/h5-7,9-13,15,21H,4,8,14H2,1-3H3/t21-/m1/s1