N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-methylphenoxy)methyl]-N-piperonyl-pyrazole-3-carboxamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O4/c1-14-4-2-3-5-17(14)25-12-23-9-8-16(22-23)20(24)21-11-15-6-7-18-19(10-15)27-13-26-18/h2-10H,11-13H2,1H3,(H,21,24)