N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide

Systemtic Name: N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide Openeye Name: N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide CAS Name: N-[1-[(2,3-dimethoxyphenyl)methyl]-4-pyrazolyl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide IUPAC Name: N-[1-[(2,3-dimethoxyphenyl)methyl]pyrazol-4-yl]-4-oxo-6,7-dihydro-5H-1-benzofuran-3-carboxamide Traditional Name: 4-keto-N-(1-o-veratrylpyrazol-4-yl)-6,7-dihydro-5H-benzofuran-3-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=O)C3=COC4=C3C(=O)CCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C=C(C=N2)NC(=O)C3=COC4=C3C(=O)CCC4

InChI

InChI=1S/C21H21N3O5/c1-27-18-8-3-5-13(20(18)28-2)10-24-11-14(9-22-24)23-21(26)15-12-29-17-7-4-6-16(25)19(15)17/h3,5,8-9,11-12H,4,6-7,10H2,1-2H3,(H,23,26)