N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide

Systemtic Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide Openeye Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide CAS Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide IUPAC Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide Traditional Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-5-[(2-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxamide Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC2=CC(=NN2)C(=O)NCC3COCCO3

Isomeric SMILES

COC1=CC=CC=C1OCC2=CC(=NN2)C(=O)NC[C@H]3COCCO3

InChI

InChI=1S/C17H21N3O5/c1-22-15-4-2-3-5-16(15)25-10-12-8-14(20-19-12)17(21)18-9-13-11-23-6-7-24-13/h2-5,8,13H,6-7,9-11H2,1H3,(H,18,21)(H,19,20)/t13-/m0/s1