1H-isoindol-1-yl 2-(7-chloranyl-1,8-naphthyridin-2-yl)-1-methyl-1-oxidanidyl-piperidin-1-ium-4-carboxylate

Systemtic Name: 1H-isoindol-1-yl 2-(7-chloranyl-1,8-naphthyridin-2-yl)-1-methyl-1-oxidanidyl-piperidin-1-ium-4-carboxylate Openeye Name: 1H-isoindol-1-yl 2-(7-chloro-1,8-naphthyridin-2-yl)-1-methyl-1-oxido-piperidin-1-ium-4-carboxylate CAS Name: 2-(7-chloro-1,8-naphthyridin-2-yl)-1-methyl-1-oxido-4-piperidin-1-iumcarboxylic acid 1H-isoindol-1-yl ester IUPAC Name: 1H-isoindol-1-yl 2-(7-chloro-1,8-naphthyridin-2-yl)-1-methyl-1-oxidopiperidin-1-ium-4-carboxylate Traditional Name: 2-(7-chloro-1,8-naphthyridin-2-yl)-1-methyl-1-oxido-piperidin-1-ium-4-carboxylic acid 1H-isoindol-1-yl ester Formula: C23H21ClN4O3 MolecularWeight: 436.89084

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1C2=NC3=C(C=C2)C=CC(=N3)Cl)C(=O)OC4C5=CC=CC=C5C=N4)[O-]

Isomeric SMILES

C[N+]1(CCC(CC1C2=NC3=C(C=C2)C=CC(=N3)Cl)C(=O)OC4C5=CC=CC=C5C=N4)[O-]

InChI

InChI=1S/C23H21ClN4O3/c1-28(30)11-10-15(23(29)31-22-17-5-3-2-4-16(17)13-25-22)12-19(28)18-8-6-14-7-9-20(24)27-21(14)26-18/h2-9,13,15,19,22H,10-12H2,1H3