5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCC4=CC=CC=C4C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCC4=CC=CC=C4C3)C#N)OC

InChI

InChI=1S/C21H19N3O3/c1-25-18-8-7-15(11-19(18)26-2)20-23-17(12-22)21(27-20)24-10-9-14-5-3-4-6-16(14)13-24/h3-8,11H,9-10,13H2,1-2H3