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

Systemtic Name: (2R)-4-[(4-methylphenyl)methyl]-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-2-isopropyl-6-propanoyl-4-(p-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: (2R)-4-[(4-methylphenyl)methyl]-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-4-[(4-methylphenyl)methyl]-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-2-isopropyl-4-(4-methylbenzyl)-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)N2CC3=CC=C(C=C3)C)C(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC3=CC=C(C=C3)C)C(C)C

InChI

InChI=1S/C22H25NO3/c1-5-19(24)17-10-11-20-18(12-17)23(22(25)21(26-20)14(2)3)13-16-8-6-15(4)7-9-16/h6-12,14,21H,5,13H2,1-4H3/t21-/m1/s1