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

Systemtic Name: (2R)-4-[(1R)-1-phenylethyl]-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-2-isopropyl-4-[(1R)-1-phenylethyl]-6-propanoyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-(1-oxopropyl)-4-[(1R)-1-phenylethyl]-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-4-[(1R)-1-phenylethyl]-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-2-isopropyl-4-[(1R)-1-phenylethyl]-6-propionyl-1,4-benzoxazin-3-one Formula: C22H25NO3 MolecularWeight: 351.4388

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO3/c1-5-19(24)17-11-12-20-18(13-17)23(22(25)21(26-20)14(2)3)15(4)16-9-7-6-8-10-16/h6-15,21H,5H2,1-4H3/t15-,21-/m1/s1