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

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-propoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-propoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-propoxyphenyl)oxazole-4-carbonitrile Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCC4=CC=CC=C4C3)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCC4=CC=CC=C4C3)C#N

InChI

InChI=1S/C22H21N3O2/c1-2-13-26-19-9-7-17(8-10-19)21-24-20(14-23)22(27-21)25-12-11-16-5-3-4-6-18(16)15-25/h3-10H,2,11-13,15H2,1H3