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

Systemtic Name: (2R)-6-butanoyl-4-(3-oxidanylpropyl)-2-phenyl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-butanoyl-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one CAS Name: (2R)-4-(3-hydroxypropyl)-6-(1-oxobutyl)-2-phenyl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-butanoyl-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-butyryl-4-(3-hydroxypropyl)-2-phenyl-1,4-benzoxazin-3-one Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CCCO)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CCCO)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO4/c1-2-7-18(24)16-10-11-19-17(14-16)22(12-6-13-23)21(25)20(26-19)15-8-4-3-5-9-15/h3-5,8-11,14,20,23H,2,6-7,12-13H2,1H3/t20-/m1/s1