3-[6-(2-methoxyethoxy)isoquinolin-1-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile

Systemtic Name: 3-[6-(2-methoxyethoxy)isoquinolin-1-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile Openeye Name: 3-[6-(2-methoxyethoxy)-1-isoquinolyl]-2-oxo-indoline-5-carbonitrile CAS Name: 3-[6-(2-methoxyethoxy)-1-isoquinolinyl]-2-oxo-1,3-dihydroindole-5-carbonitrile IUPAC Name: 3-[6-(2-methoxyethoxy)isoquinolin-1-yl]-2-oxo-1,3-dihydroindole-5-carbonitrile Traditional Name: 2-keto-3-[6-(2-methoxyethoxy)-1-isoquinolyl]indoline-5-carbonitrile Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=C(C=C1)C(=NC=C2)C3C4=C(C=CC(=C4)C#N)NC3=O

Isomeric SMILES

COCCOC1=CC2=C(C=C1)C(=NC=C2)C3C4=C(C=CC(=C4)C#N)NC3=O

InChI

InChI=1S/C21H17N3O3/c1-26-8-9-27-15-3-4-16-14(11-15)6-7-23-20(16)19-17-10-13(12-22)2-5-18(17)24-21(19)25/h2-7,10-11,19H,8-9H2,1H3,(H,24,25)