6-methoxy-4-phenyl-1-(prop-2-enylamino)isoquinoline-3-carbonitrile

Systemtic Name: 6-methoxy-4-phenyl-1-(prop-2-enylamino)isoquinoline-3-carbonitrile Openeye Name: 1-(allylamino)-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 6-methoxy-4-phenyl-1-(prop-2-enylamino)-3-isoquinolinecarbonitrile IUPAC Name: 6-methoxy-4-phenyl-1-(prop-2-enylamino)isoquinoline-3-carbonitrile Traditional Name: 1-(allylamino)-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)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O/c1-3-11-22-20-16-10-9-15(24-2)12-17(16)19(18(13-21)23-20)14-7-5-4-6-8-14/h3-10,12H,1,11H2,2H3,(H,22,23)