1-[8-bromanyl-3,3-dimethyl-2-(2-methylpropylamino)-5-oxidanyl-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[8-bromanyl-3,3-dimethyl-2-(2-methylpropylamino)-5-oxidanyl-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methyl-butan-1-one Openeye Name: 1-[8-bromo-5-hydroxy-2-(isobutylamino)-3,3-dimethyl-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methyl-butan-1-one CAS Name: 1-[8-bromo-5-hydroxy-3,3-dimethyl-2-(2-methylpropylamino)-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methyl-1-butanone IUPAC Name: 1-[8-bromo-5-hydroxy-3,3-dimethyl-2-(2-methylpropylamino)-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methylbutan-1-one Traditional Name: 1-[8-bromo-5-hydroxy-2-(isobutylamino)-3,3-dimethyl-2,4-dihydro-1,4-benzoxazin-6-yl]-3-methyl-butan-1-one Formula: C19H29BrN2O3 MolecularWeight: 413.34916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=CC(=C2C(=C1O)NC(C(O2)NCC(C)C)(C)C)Br

Isomeric SMILES

CC(C)CC(=O)C1=CC(=C2C(=C1O)NC(C(O2)NCC(C)C)(C)C)Br

InChI

InChI=1S/C19H29BrN2O3/c1-10(2)7-14(23)12-8-13(20)17-15(16(12)24)22-19(5,6)18(25-17)21-9-11(3)4/h8,10-11,18,21-22,24H,7,9H2,1-6H3