[2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxan-2-yl]carbonyl-methyl-carbamic acid

Systemtic Name: [2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxan-2-yl]carbonyl-methyl-carbamic acid Openeye Name: [2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carbonyl]-methyl-carbamic acid CAS Name: [[2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxan-2-yl]-oxomethyl]-methylcarbamic acid IUPAC Name: [2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carbonyl]-methylcarbamic acid Traditional Name: [2-(4-chlorophenyl)-5,5-diphenyl-1,3-dioxane-2-carbonyl]-methyl-carbamic acid Formula: C25H22ClNO5 MolecularWeight: 451.89888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

CN(C(=O)C1(OCC(CO1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C25H22ClNO5/c1-27(23(29)30)22(28)25(20-12-14-21(26)15-13-20)31-16-24(17-32-25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15H,16-17H2,1H3,(H,29,30)