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

Systemtic Name: (2R)-6-(2-chloranylethanoyl)-4-[(4-methylphenyl)methyl]-2-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-(2-chloroacetyl)-2-isopropyl-4-(p-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-(2-chloro-1-oxoethyl)-4-[(4-methylphenyl)methyl]-2-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-(2-chloroacetyl)-4-[(4-methylphenyl)methyl]-2-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-(2-chloroacetyl)-2-isopropyl-4-(4-methylbenzyl)-1,4-benzoxazin-3-one Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)CCl)OC(C2=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)CCl)O[C@@H](C2=O)C(C)C

InChI

InChI=1S/C21H22ClNO3/c1-13(2)20-21(25)23(12-15-6-4-14(3)5-7-15)17-10-16(18(24)11-22)8-9-19(17)26-20/h4-10,13,20H,11-12H2,1-3H3/t20-/m1/s1