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

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-1-keto-2H-isoquinoline-3-carboxamide Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=CC3=CC=CC=C3C(=O)N2)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)C2=CC3=CC=CC=C3C(=O)N2)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H21N3O2/c30-25-19-11-5-4-10-18(19)14-24(29-25)26(31)28-15-21(17-8-2-1-3-9-17)22-16-27-23-13-7-6-12-20(22)23/h1-14,16,21,27H,15H2,(H,28,31)(H,29,30)