(phenylmethyl) 2-methyl-2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylate Openeye Name: benzyl 2-benzyl-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylate CAS Name: 2-methyl-2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylate Traditional Name: 2-benzyl-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylic acid benzyl ester Formula: C28H27N2O2+ MolecularWeight: 423.52618

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C[N+]1(CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H27N2O2/c1-30(18-21-10-4-2-5-11-21)17-16-26-24(19-30)27(23-14-8-9-15-25(23)29-26)28(31)32-20-22-12-6-3-7-13-22/h2-15H,16-20H2,1H3/q+1