2-methyl-1-oxidanylidene-4-phenyl-6-pyrrolidin-3-yloxy-isoquinoline-3-carbonitrile

Systemtic Name: 2-methyl-1-oxidanylidene-4-phenyl-6-pyrrolidin-3-yloxy-isoquinoline-3-carbonitrile Openeye Name: 2-methyl-1-oxo-4-phenyl-6-pyrrolidin-3-yloxy-isoquinoline-3-carbonitrile CAS Name: 2-methyl-1-oxo-4-phenyl-6-(3-pyrrolidinyloxy)-3-isoquinolinecarbonitrile IUPAC Name: 2-methyl-1-oxo-4-phenyl-6-pyrrolidin-3-yloxyisoquinoline-3-carbonitrile Traditional Name: 1-keto-2-methyl-4-phenyl-6-pyrrolidin-3-yloxy-isoquinoline-3-carbonitrile Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC3CCNC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC3CCNC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H19N3O2/c1-24-19(12-22)20(14-5-3-2-4-6-14)18-11-15(7-8-17(18)21(24)25)26-16-9-10-23-13-16/h2-8,11,16,23H,9-10,13H2,1H3