ethyl 1-methyl-5-oxidanylidene-4-phenylmethoxy-2-(phenylmethoxymethyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 1-methyl-5-oxidanylidene-4-phenylmethoxy-2-(phenylmethoxymethyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-benzyloxy-2-(benzyloxymethyl)-1-methyl-5-oxo-pyrazole-3-carboxylate CAS Name: 1-methyl-5-oxo-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-oxo-4-phenylmethoxy-2-(phenylmethoxymethyl)pyrazole-3-carboxylate Traditional Name: 4-benzoxy-2-(benzoxymethyl)-5-keto-1-methyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1COCC2=CC=CC=C2)C)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1COCC2=CC=CC=C2)C)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-3-28-22(26)19-20(29-15-18-12-8-5-9-13-18)21(25)23(2)24(19)16-27-14-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3