2-(2-azanylethyl)-1-oxidanylidene-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 2-(2-azanylethyl)-1-oxidanylidene-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 2-(2-aminoethyl)-1-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 2-(2-aminoethyl)-1-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 2-(2-aminoethyl)-1-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 2-(2-aminoethyl)-1-keto-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C12H15N3O MolecularWeight: 217.267

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CN(C2=O)CCN)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=CN(C2=O)CCN)C#N

InChI

InChI=1S/C12H15N3O/c13-5-6-15-8-9(7-14)10-3-1-2-4-11(10)12(15)16/h8H,1-6,13H2