4-[(2,4-dimethoxyphenyl)methylamino]isoquinoline-1-carbonitrile

Systemtic Name: 4-[(2,4-dimethoxyphenyl)methylamino]isoquinoline-1-carbonitrile Openeye Name: 4-[(2,4-dimethoxyphenyl)methylamino]isoquinoline-1-carbonitrile CAS Name: 4-[(2,4-dimethoxyphenyl)methylamino]-1-isoquinolinecarbonitrile IUPAC Name: 4-[(2,4-dimethoxyphenyl)methylamino]isoquinoline-1-carbonitrile Traditional Name: 4-[(2,4-dimethoxybenzyl)amino]isoquinoline-1-carbonitrile Formula: C19H17N3O2 MolecularWeight: 319.35718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=CN=C(C3=CC=CC=C32)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=CN=C(C3=CC=CC=C32)C#N)OC

InChI

InChI=1S/C19H17N3O2/c1-23-14-8-7-13(19(9-14)24-2)11-21-18-12-22-17(10-20)15-5-3-4-6-16(15)18/h3-9,12,21H,11H2,1-2H3