[2-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: [2-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: [2-[5-(2-naphthyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid [2-[5-(2-naphthalenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester IUPAC Name: [2-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-oxoethyl] 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid [2-keto-2-[3-(2-naphthyl)-5-phenyl-2-pyrazolin-1-yl]ethyl] ester Formula: C31H27ClN2O4 MolecularWeight: 527.01008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC(=O)N1C(CC(=N1)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)OC5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C)(C(=O)OCC(=O)N1C(CC(=N1)C2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4)OC5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H27ClN2O4/c1-31(2,38-26-16-14-25(32)15-17-26)30(36)37-20-29(35)34-28(22-9-4-3-5-10-22)19-27(33-34)24-13-12-21-8-6-7-11-23(21)18-24/h3-18,28H,19-20H2,1-2H3