6-bromanyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]quinazolin-4-one CAS Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]quinazolin-4-one Formula: C22H24BrN2O4P MolecularWeight: 491.314721

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=O)N2CC=C)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=O)N2CC=C)OCC

InChI

InChI=1S/C22H24BrN2O4P/c1-4-13-25-21(24-20-12-11-18(23)14-19(20)22(25)26)17-9-7-16(8-10-17)15-30(27,28-5-2)29-6-3/h4,7-12,14H,1,5-6,13,15H2,2-3H3