(3R)-3-methyl-1-oxidanylidene-N-(2-pyrrolidin-1-ylphenyl)-4H-isochromene-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=CC=C3N4CCCC4

Isomeric SMILES

C[C@@]1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C21H22N2O3/c1-21(14-15-8-2-3-9-16(15)19(24)26-21)20(25)22-17-10-4-5-11-18(17)23-12-6-7-13-23/h2-5,8-11H,6-7,12-14H2,1H3,(H,22,25)/t21-/m1/s1