5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-styryl]oxazole-4-carbonitrile CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-2-phenylethenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-2-phenylethenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-styryl]oxazole-4-carbonitrile Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(N=C(O3)C=CC4=CC=CC=C4)C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(N=C(O3)/C=C/C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H17N3O/c22-14-19-21(24-13-12-17-8-4-5-9-18(17)15-24)25-20(23-19)11-10-16-6-2-1-3-7-16/h1-11H,12-13,15H2/b11-10+