N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenylpyrazole-3-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

InChI

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