ethyl 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 5-[[1,4-dioxan-2-ylmethyl(methyl)amino]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN(C)CC3COCCO3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN(C)CC3COCCO3

InChI

InChI=1S/C20H27N3O5/c1-4-27-20(24)18-11-21-23(15-5-7-16(25-3)8-6-15)19(18)13-22(2)12-17-14-26-9-10-28-17/h5-8,11,17H,4,9-10,12-14H2,1-3H3