N-(3-chloranyl-2,6-diethyl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-1-oxo-isochromane-3-carboxamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-1-keto-isochroman-3-carboxamide Formula: C20H20ClNO3 MolecularWeight: 357.8307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C20H20ClNO3/c1-3-12-9-10-16(21)14(4-2)18(12)22-19(23)17-11-13-7-5-6-8-15(13)20(24)25-17/h5-10,17H,3-4,11H2,1-2H3,(H,22,23)