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

Systemtic Name: 2-methyl-1-oxidanylidene-4-phenyl-6-piperidin-4-yloxy-isoquinoline-3-carbonitrile Openeye Name: 2-methyl-1-oxo-4-phenyl-6-(4-piperidyloxy)isoquinoline-3-carbonitrile CAS Name: 2-methyl-1-oxo-4-phenyl-6-(4-piperidinyloxy)-3-isoquinolinecarbonitrile IUPAC Name: 2-methyl-1-oxo-4-phenyl-6-piperidin-4-yloxyisoquinoline-3-carbonitrile Traditional Name: 1-keto-2-methyl-4-phenyl-6-(4-piperidyloxy)isoquinoline-3-carbonitrile Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC3CCNCC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC3CCNCC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H21N3O2/c1-25-20(14-23)21(15-5-3-2-4-6-15)19-13-17(7-8-18(19)22(25)26)27-16-9-11-24-12-10-16/h2-8,13,16,24H,9-12H2,1H3