2-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate

Systemtic Name: 2-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Openeye Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate CAS Name: 2-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate IUPAC Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Traditional Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C(C3=CC=CC=C3N=C21)C(=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC2=C(C3=CC=CC=C3N=C21)C(=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C20H18N2O2/c23-20(24)19-15-8-4-5-9-17(15)21-18-10-11-22(13-16(18)19)12-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,23,24)