N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-cyclopropyl-N-(2,5-dimethoxybenzyl)-1-keto-isochroman-3-carboxamide Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C22H23NO5/c1-26-17-9-10-19(27-2)15(11-17)13-23(16-7-8-16)21(24)20-12-14-5-3-4-6-18(14)22(25)28-20/h3-6,9-11,16,20H,7-8,12-13H2,1-2H3