2-(3-azanylisoindol-1-ylidene)-3-oxidanylidene-3-piperidin-1-yl-propanenitrile

Systemtic Name: 2-(3-azanylisoindol-1-ylidene)-3-oxidanylidene-3-piperidin-1-yl-propanenitrile Openeye Name: 2-(3-aminoisoindol-1-ylidene)-3-oxo-3-(1-piperidyl)propanenitrile CAS Name: 2-(3-amino-1-isoindolylidene)-3-oxo-3-(1-piperidinyl)propanenitrile IUPAC Name: 2-(3-aminoisoindol-1-ylidene)-3-oxo-3-piperidin-1-ylpropanenitrile Traditional Name: 2-(3-aminoisoindol-1-ylidene)-3-keto-3-piperidino-propionitrile Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=C2C3=CC=CC=C3C(=N2)N)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)C(=C2C3=CC=CC=C3C(=N2)N)C#N

InChI

InChI=1S/C16H16N4O/c17-10-13(16(21)20-8-4-1-5-9-20)14-11-6-2-3-7-12(11)15(18)19-14/h2-3,6-7H,1,4-5,8-9H2,(H2,18,19)