N-[2-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-2-ium-3-yl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-2-ium-3-yl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[2-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-2-ium-3-yl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[2-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-2-ium-3-yl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[2-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-2-ium-3-yl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-(2-o-veratryl-1H-pyrazol-2-ium-3-yl)coumarilamide Formula: C22H22N3O4+ MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC3=[N+](NC=C3)CC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC3=[N+](NC=C3)CC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C22H21N3O4/c1-14-16-8-4-5-9-17(16)29-20(14)22(26)24-19-11-12-23-25(19)13-15-7-6-10-18(27-2)21(15)28-3/h4-12H,13H2,1-3H3,(H,23,24,26)/p+1