1-(4-bromophenyl)-3-[(2,4-dichlorophenyl)methyl]-2-oxidanylidene-1,3-diazinane-5-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-3-[(2,4-dichlorophenyl)methyl]-2-oxidanylidene-1,3-diazinane-5-carboxylic acid Openeye Name: 1-(4-bromophenyl)-3-[(2,4-dichlorophenyl)methyl]-2-oxo-hexahydropyrimidine-5-carboxylic acid CAS Name: 1-(4-bromophenyl)-3-[(2,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinane-5-carboxylic acid IUPAC Name: 1-(4-bromophenyl)-3-[(2,4-dichlorophenyl)methyl]-2-oxo-1,3-diazinane-5-carboxylic acid Traditional Name: 1-(4-bromophenyl)-3-(2,4-dichlorobenzyl)-2-keto-hexahydropyrimidine-5-carboxylic acid Formula: C18H15BrCl2N2O3 MolecularWeight: 458.1333

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)N1CC2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1C(CN(C(=O)N1CC2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C18H15BrCl2N2O3/c19-13-2-5-15(6-3-13)23-10-12(17(24)25)9-22(18(23)26)8-11-1-4-14(20)7-16(11)21/h1-7,12H,8-10H2,(H,24,25)