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

Systemtic Name: 2-methyl-4-oxidanylidene-6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-3-carbonitrile Openeye Name: 6-benzyl-2-methyl-4-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-3-carbonitrile CAS Name: 2-methyl-4-oxo-6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-3-carbonitrile IUPAC Name: 6-benzyl-2-methyl-4-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-3-carbonitrile Traditional Name: 6-benzyl-4-keto-2-methyl-5,6,7,8-tetrahydro-1H-1,6-naphthyridin-6-ium-3-carbonitrile Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)CC[NH+](C2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)CC[NH+](C2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C17H17N3O/c1-12-14(9-18)17(21)15-11-20(8-7-16(15)19-12)10-13-5-3-2-4-6-13/h2-6H,7-8,10-11H2,1H3,(H,19,21)/p+1