[4-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)phenyl]methyl-(2-methylpropoxy)phosphinic acid

Systemtic Name: [4-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)phenyl]methyl-(2-methylpropoxy)phosphinic acid Openeye Name: [4-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)phenyl]methyl-isobutoxy-phosphinic acid CAS Name: [4-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)phenyl]methyl-(2-methylpropoxy)phosphinic acid IUPAC Name: [4-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)phenyl]methyl-(2-methylpropoxy)phosphinic acid Traditional Name: [4-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)benzyl]-isobutoxy-phosphinic acid Formula: C20H22ClN2O4P MolecularWeight: 420.826441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C)O

Isomeric SMILES

CC(C)COP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C)O

InChI

InChI=1S/C20H22ClN2O4P/c1-13(2)11-27-28(25,26)12-14-4-6-15(7-5-14)19-22-18-10-16(21)8-9-17(18)20(24)23(19)3/h4-10,13H,11-12H2,1-3H3,(H,25,26)