6-bromanyl-2-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-1H-quinazolin-4-one Openeye Name: 6-bromo-2-[4-(diisopropoxyphosphorylmethyl)phenyl]-1H-quinazolin-4-one CAS Name: 6-bromo-2-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-1H-quinazolin-4-one IUPAC Name: 6-bromo-2-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-1H-quinazolin-4-one Traditional Name: 6-bromo-2-[4-(diisopropoxyphosphorylmethyl)phenyl]-1H-quinazolin-4-one Formula: C21H24BrN2O4P MolecularWeight: 479.304021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(CC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)Br)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(CC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)Br)OC(C)C

InChI

InChI=1S/C21H24BrN2O4P/c1-13(2)27-29(26,28-14(3)4)12-15-5-7-16(8-6-15)20-23-19-10-9-17(22)11-18(19)21(25)24-20/h5-11,13-14H,12H2,1-4H3,(H,23,24,25)