4-[1-[2,6-bis(chloranyl)phenyl]-5-(2-chlorophenyl)-2-oxidanylidene-3,4-dihydroquinazolin-7-yl]pyrrolidine-3-carboxylic acid

Systemtic Name: 4-[1-[2,6-bis(chloranyl)phenyl]-5-(2-chlorophenyl)-2-oxidanylidene-3,4-dihydroquinazolin-7-yl]pyrrolidine-3-carboxylic acid Openeye Name: 4-[5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]pyrrolidine-3-carboxylic acid CAS Name: 4-[5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]-3-pyrrolidinecarboxylic acid IUPAC Name: 4-[5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-dihydroquinazolin-7-yl]pyrrolidine-3-carboxylic acid Traditional Name: 4-[5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-keto-3,4-dihydroquinazolin-7-yl]pyrrolidine-3-carboxylic acid Formula: C25H20Cl3N3O3 MolecularWeight: 516.8036

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)C(=O)O)C2=CC3=C(CNC(=O)N3C4=C(C=CC=C4Cl)Cl)C(=C2)C5=CC=CC=C5Cl

Isomeric SMILES

C1C(C(CN1)C(=O)O)C2=CC3=C(CNC(=O)N3C4=C(C=CC=C4Cl)Cl)C(=C2)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H20Cl3N3O3/c26-19-5-2-1-4-14(19)15-8-13(16-10-29-11-18(16)24(32)33)9-22-17(15)12-30-25(34)31(22)23-20(27)6-3-7-21(23)28/h1-9,16,18,29H,10-12H2,(H,30,34)(H,32,33)