N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-methyl-4-pyrrolidin-1-ylphenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-(2-methyl-4-pyrrolidino-phenyl)isochroman-3-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H22N2O3/c1-14-12-16(23-10-4-5-11-23)8-9-18(14)22-20(24)19-13-15-6-2-3-7-17(15)21(25)26-19/h2-3,6-9,12,19H,4-5,10-11,13H2,1H3,(H,22,24)