N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-keto-2H-isoquinoline-3-carboxamide Formula: C20H16ClN3O2 MolecularWeight: 365.81294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NCCC3=CNC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NCCC3=CNC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN3O2/c21-14-5-6-17-16(10-14)13(11-23-17)7-8-22-20(26)18-9-12-3-1-2-4-15(12)19(25)24-18/h1-6,9-11,23H,7-8H2,(H,22,26)(H,24,25)