1-[(5-chloranyl-3-methyl-2-oxidanyl-phenyl)methyl]-2H-3,1-benzoxazin-4-one

Systemtic Name: 1-[(5-chloranyl-3-methyl-2-oxidanyl-phenyl)methyl]-2H-3,1-benzoxazin-4-one Openeye Name: 1-[(5-chloro-2-hydroxy-3-methyl-phenyl)methyl]-2H-3,1-benzoxazin-4-one CAS Name: 1-[(5-chloro-2-hydroxy-3-methylphenyl)methyl]-2H-3,1-benzoxazin-4-one IUPAC Name: 1-[(5-chloro-2-hydroxy-3-methylphenyl)methyl]-2H-3,1-benzoxazin-4-one Traditional Name: 1-(5-chloro-2-hydroxy-3-methyl-benzyl)-2H-3,1-benzoxazin-4-one Formula: C16H14ClNO3 MolecularWeight: 303.74026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)CN2COC(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

CC1=CC(=CC(=C1O)CN2COC(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C16H14ClNO3/c1-10-6-12(17)7-11(15(10)19)8-18-9-21-16(20)13-4-2-3-5-14(13)18/h2-7,19H,8-9H2,1H3