1-oxidanyl-3-oxidanylidene-7-(phenylmethyl)-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1-oxidanyl-3-oxidanylidene-7-(phenylmethyl)-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 7-benzyl-1-hydroxy-3-oxo-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1-hydroxy-3-oxo-7-(phenylmethyl)-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 7-benzyl-1-hydroxy-3-oxo-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 7-benzyl-1-hydroxy-3-keto-5,6,7,8-tetrahydro-2H-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C(NC(=O)C(=C21)C#N)O)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC2=C(NC(=O)C(=C21)C#N)O)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2/c17-8-13-12-6-7-19(9-11-4-2-1-3-5-11)10-14(12)16(21)18-15(13)20/h1-5H,6-7,9-10H2,(H2,18,20,21)/p+1