(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate CAS Name: 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Traditional Name: 2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C28H24N3O3S+ MolecularWeight: 482.57346

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

C[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C28H23N3O3S/c1-30-15-14-21-19(16-30)27(18-8-2-3-9-20(18)29-21)28(33)34-17-26(32)31-22-10-4-6-12-24(22)35-25-13-7-5-11-23(25)31/h2-13H,14-17H2,1H3/p+1