[3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl] 4-(2,2-dimethylpropanoyloxymethyl)-4-methyl-5-oxidanylidene-2-phenyl-pyrazolidine-1-carboxylate

Systemtic Name: [3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-oxidanyl-naphthalen-1-yl] 4-(2,2-dimethylpropanoyloxymethyl)-4-methyl-5-oxidanylidene-2-phenyl-pyrazolidine-1-carboxylate Openeye Name: [3-[(2-dodecoxy-5-methyl-phenyl)carbamoyl]-4-hydroxy-1-naphthyl] 4-(2,2-dimethylpropanoyloxymethyl)-4-methyl-5-oxo-2-phenyl-pyrazolidine-1-carboxylate CAS Name: 4-[(2,2-dimethyl-1-oxopropoxy)methyl]-4-methyl-5-oxo-2-phenyl-1-pyrazolidinecarboxylic acid [3-[(2-dodecoxy-5-methylanilino)-oxomethyl]-4-hydroxy-1-naphthalenyl] ester IUPAC Name: [3-[(2-dodecoxy-5-methylphenyl)carbamoyl]-4-hydroxynaphthalen-1-yl] 4-(2,2-dimethylpropanoyloxymethyl)-4-methyl-5-oxo-2-phenylpyrazolidine-1-carboxylate Traditional Name: 5-keto-4-methyl-2-phenyl-4-(pivaloyloxymethyl)pyrazolidine-1-carboxylic acid [4-hydroxy-3-[(2-lauryloxy-5-methyl-phenyl)carbamoyl]-1-naphthyl] ester Formula: C47H59N3O8 MolecularWeight: 793.98666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C)NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC(=O)N4C(=O)C(CN4C5=CC=CC=C5)(C)COC(=O)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C)NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC(=O)N4C(=O)C(CN4C5=CC=CC=C5)(C)COC(=O)C(C)(C)C)O

InChI

InChI=1S/C47H59N3O8/c1-7-8-9-10-11-12-13-14-15-21-28-56-39-27-26-33(2)29-38(39)48-42(52)37-30-40(35-24-19-20-25-36(35)41(37)51)58-45(55)50-43(53)47(6,32-57-44(54)46(3,4)5)31-49(50)34-22-17-16-18-23-34/h16-20,22-27,29-30,51H,7-15,21,28,31-32H2,1-6H3,(H,48,52)