3-[3-(2-cyanopropyl)-5-(5-methanoylimidazol-1-yl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 3-[3-(2-cyanopropyl)-5-(5-methanoylimidazol-1-yl)phenyl]-2-methyl-propanenitrile Openeye Name: 3-[3-(2-cyanopropyl)-5-(5-formylimidazol-1-yl)phenyl]-2-methyl-propanenitrile CAS Name: 3-[3-(2-cyanopropyl)-5-(5-formyl-1-imidazolyl)phenyl]-2-methylpropanenitrile IUPAC Name: 3-[3-(2-cyanopropyl)-5-(5-formylimidazol-1-yl)phenyl]-2-methylpropanenitrile Traditional Name: 3-[3-(2-cyanopropyl)-5-(5-formylimidazol-1-yl)phenyl]-2-methyl-propionitrile Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC(=C1)N2C=NC=C2C=O)CC(C)C#N)C#N

Isomeric SMILES

CC(CC1=CC(=CC(=C1)N2C=NC=C2C=O)CC(C)C#N)C#N

InChI

InChI=1S/C18H18N4O/c1-13(8-19)3-15-5-16(4-14(2)9-20)7-17(6-15)22-12-21-10-18(22)11-23/h5-7,10-14H,3-4H2,1-2H3