[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone

Systemtic Name: [2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone Openeye Name: [2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone CAS Name: [2-(1,3-benzodioxol-5-yloxymethyl)-4-morpholinyl]-(1-phenyl-5-propyl-4-pyrazolyl)methanone IUPAC Name: [2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-(1-phenyl-5-propylpyrazol-4-yl)methanone Traditional Name: [2-(1,3-benzodioxol-5-yloxymethyl)morpholino]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCOC(C3)COC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCOC(C3)COC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H27N3O5/c1-2-6-22-21(14-26-28(22)18-7-4-3-5-8-18)25(29)27-11-12-30-20(15-27)16-31-19-9-10-23-24(13-19)33-17-32-23/h3-5,7-10,13-14,20H,2,6,11-12,15-17H2,1H3