2,2-dimethyl-4-[(1R)-1-phenylethyl]-6-propanoyl-1,4-benzoxazin-3-one

Systemtic Name: 2,2-dimethyl-4-[(1R)-1-phenylethyl]-6-propanoyl-1,4-benzoxazin-3-one Openeye Name: 2,2-dimethyl-4-[(1R)-1-phenylethyl]-6-propanoyl-1,4-benzoxazin-3-one CAS Name: 2,2-dimethyl-6-(1-oxopropyl)-4-[(1R)-1-phenylethyl]-1,4-benzoxazin-3-one IUPAC Name: 2,2-dimethyl-4-[(1R)-1-phenylethyl]-6-propanoyl-1,4-benzoxazin-3-one Traditional Name: 2,2-dimethyl-4-[(1R)-1-phenylethyl]-6-propionyl-1,4-benzoxazin-3-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2C(C)C3=CC=CC=C3)(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2[C@H](C)C3=CC=CC=C3)(C)C

InChI

InChI=1S/C21H23NO3/c1-5-18(23)16-11-12-19-17(13-16)22(20(24)21(3,4)25-19)14(2)15-9-7-6-8-10-15/h6-14H,5H2,1-4H3/t14-/m1/s1