6-bromanyl-N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-bromo-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-isochromane-3-carboxamide CAS Name: 6-bromo-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-bromo-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-keto-isochroman-3-carboxamide Formula: C20H16BrClN2O3 MolecularWeight: 447.70964

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)Br)C(=O)NCCC3=CNC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1C(OC(=O)C2=C1C=C(C=C2)Br)C(=O)NCCC3=CNC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C20H16BrClN2O3/c21-13-1-3-15-12(7-13)8-18(27-20(15)26)19(25)23-6-5-11-10-24-17-4-2-14(22)9-16(11)17/h1-4,7,9-10,18,24H,5-6,8H2,(H,23,25)