2-[1-[(2,4-dichlorophenyl)methyl]-3-naphthalen-1-yl-2-oxidanylidene-1,3-diazinan-5-yl]ethanoic acid

Systemtic Name: 2-[1-[(2,4-dichlorophenyl)methyl]-3-naphthalen-1-yl-2-oxidanylidene-1,3-diazinan-5-yl]ethanoic acid Openeye Name: 2-[1-[(2,4-dichlorophenyl)methyl]-3-(1-naphthyl)-2-oxo-hexahydropyrimidin-5-yl]acetic acid CAS Name: 2-[1-[(2,4-dichlorophenyl)methyl]-3-(1-naphthalenyl)-2-oxo-1,3-diazinan-5-yl]acetic acid IUPAC Name: 2-[1-[(2,4-dichlorophenyl)methyl]-3-naphthalen-1-yl-2-oxo-1,3-diazinan-5-yl]acetic acid Traditional Name: 2-[1-(2,4-dichlorobenzyl)-2-keto-3-(1-naphthyl)hexahydropyrimidin-5-yl]acetic acid Formula: C23H20Cl2N2O3 MolecularWeight: 443.3225

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)N1CC2=C(C=C(C=C2)Cl)Cl)C3=CC=CC4=CC=CC=C43)CC(=O)O

Isomeric SMILES

C1C(CN(C(=O)N1CC2=C(C=C(C=C2)Cl)Cl)C3=CC=CC4=CC=CC=C43)CC(=O)O

InChI

InChI=1S/C23H20Cl2N2O3/c24-18-9-8-17(20(25)11-18)14-26-12-15(10-22(28)29)13-27(23(26)30)21-7-3-5-16-4-1-2-6-19(16)21/h1-9,11,15H,10,12-14H2,(H,28,29)