(3R)-7-chloranyl-N-[4-(diethylamino)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-7-chloranyl-N-[4-(diethylamino)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-7-chloro-N-[4-(diethylamino)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-7-chloro-N-[4-(diethylamino)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-7-chloro-N-[4-(diethylamino)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-7-chloro-N-[4-(diethylamino)phenyl]-1-keto-isochroman-3-carboxamide Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)C2CC3=C(C=C(C=C3)Cl)C(=O)O2

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)[C@H]2CC3=C(C=C(C=C3)Cl)C(=O)O2

InChI

InChI=1S/C20H21ClN2O3/c1-3-23(4-2)16-9-7-15(8-10-16)22-19(24)18-11-13-5-6-14(21)12-17(13)20(25)26-18/h5-10,12,18H,3-4,11H2,1-2H3,(H,22,24)/t18-/m1/s1