1-(azetidin-1-yl)-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 1-(azetidin-1-yl)-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 1-(azetidin-1-yl)-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 1-(1-azetidinyl)-6-methoxy-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 1-(azetidin-1-yl)-6-methoxy-4-phenylisoquinoline-3-carbonitrile Traditional Name: 1-(azetidin-1-yl)-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile Formula: C20H17N3O MolecularWeight: 315.36848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=C2C3=CC=CC=C3)C#N)N4CCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=C2C3=CC=CC=C3)C#N)N4CCC4

InChI

InChI=1S/C20H17N3O/c1-24-15-8-9-16-17(12-15)19(14-6-3-2-4-7-14)18(13-21)22-20(16)23-10-5-11-23/h2-4,6-9,12H,5,10-11H2,1H3