N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-3-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-methyl-propionamide Formula: C21H23BrN2O4 MolecularWeight: 447.32232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)N(C)CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

C[C@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)N(C)CC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H23BrN2O4/c1-14-21(26)24(17-6-4-5-7-19(17)28-14)11-10-20(25)23(2)13-15-12-16(22)8-9-18(15)27-3/h4-9,12,14H,10-11,13H2,1-3H3/t14-/m0/s1