N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-1-keto-isochroman-3-carboxamide Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1CC2=CC=CC=C2C(=O)O1)C3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)C(CNC(=O)C1CC2=CC=CC=C2C(=O)O1)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H25ClN2O3/c1-3-25(4-2)19(17-11-7-8-12-18(17)23)14-24-21(26)20-13-15-9-5-6-10-16(15)22(27)28-20/h5-12,19-20H,3-4,13-14H2,1-2H3,(H,24,26)